5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide

C13H21N3O3 — CID 62896987

IUPAC5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide
SMILESCC(C)N1CC(C(=O)NC2CCC(=O)NC2)CC1=O
InChIInChI=1S/C13H21N3O3/c1-8(2)16-7-9(5-12(16)18)13(19)15-10-3-4-11(17)14-6-10/h8-10H,3-7H2,1-2H3,(H,14,17)(H,15,19)
InChIKeyHOVFSXRUEUFDLF-UHFFFAOYSA-N
MW267.33 g/mol
LogP-0.36
Rot. Bonds3

About 5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide

5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide (PubChem CID 62896987) has the molecular formula C13H21N3O3 and a molecular weight of 267.33 g/mol. Its IUPAC name is 5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide.

Molecular Properties

Compound Name5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide
PubChem CID62896987
Molecular FormulaC13H21N3O3
Molecular Weight267.33 g/mol
Exact Mass267.16
IUPAC Name5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide
SMILESCC(C)N1CC(C(=O)NC2CCC(=O)NC2)CC1=O
InChIInChI=1S/C13H21N3O3/c1-8(2)16-7-9(5-12(16)18)13(19)15-10-3-4-11(17)14-6-10/h8-10H,3-7H2,1-2H3,(H,14,17)(H,15,19)
InChIKeyHOVFSXRUEUFDLF-UHFFFAOYSA-N
XLogP-0.36
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-oxopiperidin-3-yl)pyrrolidine-3-carboxamide
CID 63663368
5-oxo-1-pentan-3-yl-N-pyrrolidin-3-ylpyrrolidine-3-carboxamide;hydrochloride
CID 119450895
5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide
CID 119427312
(3R)-5-oxo-N-[(3S)-2-oxothiolan-3-yl]-1-propan-2-ylpyrrolidine-3-carboxamide
CID 9400945
N,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide
CID 108560686
2-(methylamino)-N-(6-oxopiperidin-3-yl)propanamide
CID 63663000
6-oxo-N-[(3S)-pyrrolidin-3-yl]piperidine-3-carboxamide
CID 83192394
N-(2-adamantyl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 78859348
6-oxo-N-(5-oxopyrrolidin-3-yl)piperidine-3-carboxamide
CID 104580966
N-(2,6-dioxopiperidin-3-yl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide
CID 146129255
(6-oxopiperidin-3-yl)carbamic acid
CID 77299994
N-(6-oxopiperidin-3-yl)adamantane-2-carboxamide
CID 78990985

Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide?
The IUPAC name of 5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide (CID 62896987) is 5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide.
What is the SMILES notation for 5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide?
The canonical SMILES for 5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide is CC(C)N1CC(C(=O)NC2CCC(=O)NC2)CC1=O.
What is the InChIKey of 5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide?
The InChIKey is HOVFSXRUEUFDLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O3/c1-8(2)16-7-9(5-12(16)18)13(19)15-10-3-4-11(17)14-6-10/h8-10H,3-7H2,1-2H3,(H,14,17)(H,15,19).
What are the key properties of 5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide?
5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide has a molecular weight of 267.33 g/mol, XLogP of -0.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide is sourced from PubChem (CID 62896987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).