3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide

C17H18N4O3 — CID 18452994

IUPAC3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide
SMILESNC(=O)N1CCC(NC(=O)c2ccc(-n3ccccc3=O)cc2)C1
InChIInChI=1S/C17H18N4O3/c18-17(24)20-10-8-13(11-20)19-16(23)12-4-6-14(7-5-12)21-9-2-1-3-15(21)22/h1-7,9,13H,8,10-11H2,(H2,18,24)(H,19,23)
InChIKeyOJNBNMGCFNGKLY-UHFFFAOYSA-N
MW326.36 g/mol
LogP0.72
Rot. Bonds3

About 3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide

3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide (PubChem CID 18452994) has the molecular formula C17H18N4O3 and a molecular weight of 326.36 g/mol. Its IUPAC name is 3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide
PubChem CID18452994
Molecular FormulaC17H18N4O3
Molecular Weight326.36 g/mol
Exact Mass326.14
IUPAC Name3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide
SMILESNC(=O)N1CCC(NC(=O)c2ccc(-n3ccccc3=O)cc2)C1
InChIInChI=1S/C17H18N4O3/c18-17(24)20-10-8-13(11-20)19-16(23)12-4-6-14(7-5-12)21-9-2-1-3-15(21)22/h1-7,9,13H,8,10-11H2,(H2,18,24)(H,19,23)
InChIKeyOJNBNMGCFNGKLY-UHFFFAOYSA-N
XLogP0.72
TPSA97.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3S,4R)-4-amino-1-(cyclopropanecarbonyl)piperidin-3-yl]-4-(2-oxo-1-pyridinyl)benzamide
CID 58845419
3-[[4-[(N-methylanilino)methyl]benzoyl]amino]pyrrolidine-1-carboxamide
CID 167931062
8-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]-1-oxaspiro[4.5]decane-2-carboxamide
CID 18453238
tert-butyl (3R,4S)-4-amino-3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]piperidine-1-carboxylate
CID 69437324
3-[[3-(trifluoromethyl)benzoyl]amino]pyrrolidine-1-carboxamide
CID 136525672
N-[2-[(4-chlorobenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide
CID 75027304
N-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide
CID 163680968
N-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide
CID 69442634
(3R)-3-[[2-(4-bromobenzoyl)benzoyl]amino]pyrrolidine-1-carboxamide
CID 99807958
N-(2-amino-2,3-dihydro-1H-inden-1-yl)-4-(2-oxo-1-pyridinyl)benzamide
CID 69173385
5-chloro-N-[1-(cyclopropanecarbonyl)-4-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]piperidin-3-yl]thiophene-2-carboxamide
CID 67308477
N-[1-[2-(2-oxo-1-pyridinyl)acetyl]piperidin-4-yl]benzamide
CID 24645620

Frequently Asked Questions

What is the IUPAC name of 3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide?
The IUPAC name of 3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide (CID 18452994) is 3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide.
What is the SMILES notation for 3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide?
The canonical SMILES for 3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide is NC(=O)N1CCC(NC(=O)c2ccc(-n3ccccc3=O)cc2)C1.
What is the InChIKey of 3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide?
The InChIKey is OJNBNMGCFNGKLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O3/c18-17(24)20-10-8-13(11-20)19-16(23)12-4-6-14(7-5-12)21-9-2-1-3-15(21)22/h1-7,9,13H,8,10-11H2,(H2,18,24)(H,19,23).
What are the key properties of 3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide?
3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide has a molecular weight of 326.36 g/mol, XLogP of 0.72, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide is sourced from PubChem (CID 18452994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).