6072-0024 Screening compound: 1-[(piperidin-3-yl)methyl]pyrrolidin-2-one

6072-0024 Screening compound: 1-[(piperidin-3-yl)methyl]pyrrolidin-2-one
6072-0024 Screening compound: 1-[(piperidin-3-yl)methyl]pyrrolidin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6072-0024
1-[(piperidin-3-yl)methyl]pyrrolidin-2-one

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

6072-0024

Molecular Formula

C10H18N2O (C10 H18 N2 O)

Compound Name

1-[(piperidin-3-yl)methyl]pyrrolidin-2-one

IUPAC name

1-[(piperidin-3-yl)methyl]pyrrolidin-2-one

SMILES

O=C1N(CC2CNCCC2)CCC1

InChI

InChI=1S/C10H18N2O/c13-10-4-2-6-12(10)8-9-3-1-5-11-7-9/h9,11H,1-8H2/t9-/m0/s1

InChI Key

PNQLQOFVZKTDSF-VIFPVBQESA-N

MDL Number (MFCD)

MFCD06408761

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

182.27

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

-0.373

Distribution Coefficient, logD

-3.237

Water Solubility, LogSw

-0.48

Polar Surface Area

29.585

Acid Dissociation Constant (pKa)

16.88

Base Dissociation Constant (pKb)

10.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

90.00

6072-0024 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS MPO Library (28609 compounds)

Akt-Targeted Library (14764 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
Therapeutical areas:
  • Nervous system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 6072-0024 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6072-0024?
Check Price and Availability of 6072-0024, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 6072-0024 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6072-0024
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6072-0024
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 6072-0024 available by request