2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide

C13H17N3O3 — CID 96999308

IUPAC2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide
SMILESC[C@H](NC(=O)c1ccc[nH]c1=O)C(=O)N1CCCC1
InChIInChI=1S/C13H17N3O3/c1-9(13(19)16-7-2-3-8-16)15-12(18)10-5-4-6-14-11(10)17/h4-6,9H,2-3,7-8H2,1H3,(H,14,17)(H,15,18)/t9-/m0/s1
InChIKeyXIGQTFPAPUQSCY-VIFPVBQESA-N
MW263.30 g/mol
LogP0.12
Rot. Bonds3

About 2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide

2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide (PubChem CID 96999308) has the molecular formula C13H17N3O3 and a molecular weight of 263.30 g/mol. Its IUPAC name is 2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide
PubChem CID96999308
Molecular FormulaC13H17N3O3
Molecular Weight263.30 g/mol
Exact Mass263.13
IUPAC Name2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide
SMILESC[C@H](NC(=O)c1ccc[nH]c1=O)C(=O)N1CCCC1
InChIInChI=1S/C13H17N3O3/c1-9(13(19)16-7-2-3-8-16)15-12(18)10-5-4-6-14-11(10)17/h4-6,9H,2-3,7-8H2,1H3,(H,14,17)(H,15,18)/t9-/m0/s1
InChIKeyXIGQTFPAPUQSCY-VIFPVBQESA-N
XLogP0.12
TPSA82.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide with MolForge

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Related Compounds

1-(2-Oxo-2-pyrrolidin-1-ylethyl)-3-(propylamino)pyridin-2-one
CID 45269129
N-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)-3-pyridinyl]acetamide
CID 45269134
6-methyl-N-[2-methyl-3-(2-oxopyrrolidin-1-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide
CID 72046954
6-methyl-2-oxo-N-(1-propan-2-ylpyrrolidin-3-yl)-1H-pyridine-3-carboxamide
CID 72046979
6-methyl-2-oxo-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-1H-pyridine-3-carboxamide
CID 72048707
N-(1-cyclopropyl-5-oxopyrrolidin-3-yl)-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxamide
CID 71789174
2-oxo-N-[(2S)-pentan-2-yl]-1H-pyridine-3-carboxamide
CID 30481294
N-[2-(cyclopropylamino)-2-oxoethyl]-2-oxo-1H-pyridine-3-carboxamide
CID 45867421
N-(6-oxo-1-propyl-3-pyridinyl)pyrrolidine-2-carboxamide
CID 54862504
6-methyl-N-[2-(methylamino)-2-oxoethyl]-2-oxo-N-propyl-1H-pyridine-3-carboxamide
CID 72047422
3-(3-piperidin-1-ylpyrrolidine-1-carbonyl)-1H-pyridin-2-one
CID 86287229
N~2~-methyl-N~1~-[3-(6-methyl-2-oxopyridin-1(2H)-yl)propyl]-L-alaninamide
CID 91828411

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide?
The IUPAC name of 2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide (CID 96999308) is 2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide.
What is the SMILES notation for 2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide?
The canonical SMILES for 2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide is C[C@H](NC(=O)c1ccc[nH]c1=O)C(=O)N1CCCC1.
What is the InChIKey of 2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide?
The InChIKey is XIGQTFPAPUQSCY-VIFPVBQESA-N. The full InChI is InChI=1S/C13H17N3O3/c1-9(13(19)16-7-2-3-8-16)15-12(18)10-5-4-6-14-11(10)17/h4-6,9H,2-3,7-8H2,1H3,(H,14,17)(H,15,18)/t9-/m0/s1.
What are the key properties of 2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide?
2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide has a molecular weight of 263.30 g/mol, XLogP of 0.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-1H-pyridine-3-carboxamide is sourced from PubChem (CID 96999308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).