N-(2-oxopiperidin-3-yl)butanamide

C9H16N2O2 — CID 62054699

IUPACN-(2-oxopiperidin-3-yl)butanamide
SMILESCCCC(=O)NC1CCCNC1=O
InChIInChI=1S/C9H16N2O2/c1-2-4-8(12)11-7-5-3-6-10-9(7)13/h7H,2-6H2,1H3,(H,10,13)(H,11,12)
InChIKeyJQSWAAZEMRZFBK-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.18
Rot. Bonds3

About N-(2-oxopiperidin-3-yl)butanamide

N-(2-oxopiperidin-3-yl)butanamide (PubChem CID 62054699) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is N-(2-oxopiperidin-3-yl)butanamide.

Molecular Properties

Compound NameN-(2-oxopiperidin-3-yl)butanamide
PubChem CID62054699
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC NameN-(2-oxopiperidin-3-yl)butanamide
SMILESCCCC(=O)NC1CCCNC1=O
InChIInChI=1S/C9H16N2O2/c1-2-4-8(12)11-7-5-3-6-10-9(7)13/h7H,2-6H2,1H3,(H,10,13)(H,11,12)
InChIKeyJQSWAAZEMRZFBK-UHFFFAOYSA-N
XLogP0.18
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-oxopiperidin-3-yl)-3-sulfanylpropanamide
CID 107027904
N-[(3S)-2-oxoazepan-3-yl]octadecanamide
CID 11246417
3-(tert-butylamino)-N-(2-oxopiperidin-3-yl)propanamide
CID 55033831
6-oxo-6-[(2-oxopiperidin-3-yl)amino]hexanoic acid
CID 55033636
3-cyclopentyl-N-(2-oxopiperidin-3-yl)propanamide
CID 47478331
4-oxo-4-[[(3S)-2-oxoazepan-3-yl]amino]butanoic acid
CID 6930772
2-(tert-butylamino)-N-(2-oxopiperidin-3-yl)acetamide
CID 49495846
(Z)-N-(2-oxoazepan-3-yl)pent-3-enamide
CID 143446170
N-(2-oxopiperidin-3-yl)-3-piperidin-2-ylpropanamide
CID 62211506
(3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide
CID 10595238
4-(4-ethoxyphenyl)-4-oxo-N-(2-oxopiperidin-3-yl)butanamide
CID 51099351
4-(4-ethoxyphenyl)-4-oxo-N-[(3S)-2-oxopiperidin-3-yl]butanamide
CID 94799342

Frequently Asked Questions

What is the IUPAC name of N-(2-oxopiperidin-3-yl)butanamide?
The IUPAC name of N-(2-oxopiperidin-3-yl)butanamide (CID 62054699) is N-(2-oxopiperidin-3-yl)butanamide.
What is the SMILES notation for N-(2-oxopiperidin-3-yl)butanamide?
The canonical SMILES for N-(2-oxopiperidin-3-yl)butanamide is CCCC(=O)NC1CCCNC1=O.
What is the InChIKey of N-(2-oxopiperidin-3-yl)butanamide?
The InChIKey is JQSWAAZEMRZFBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-2-4-8(12)11-7-5-3-6-10-9(7)13/h7H,2-6H2,1H3,(H,10,13)(H,11,12).
What are the key properties of N-(2-oxopiperidin-3-yl)butanamide?
N-(2-oxopiperidin-3-yl)butanamide has a molecular weight of 184.24 g/mol, XLogP of 0.18, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxopiperidin-3-yl)butanamide is sourced from PubChem (CID 62054699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).