N-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide

C14H13N3O3 — CID 75414588

IUPACN-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide
SMILESNC(=O)Cc1ccc(NC(=O)c2ccc[nH]c2=O)cc1
InChIInChI=1S/C14H13N3O3/c15-12(18)8-9-3-5-10(6-4-9)17-14(20)11-2-1-7-16-13(11)19/h1-7H,8H2,(H2,15,18)(H,16,19)(H,17,20)
InChIKeyJSNVTYIDVKQNPY-UHFFFAOYSA-N
MW271.28 g/mol
LogP0.65
Rot. Bonds4

About N-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide

N-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 75414588) has the molecular formula C14H13N3O3 and a molecular weight of 271.28 g/mol. Its IUPAC name is N-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide
PubChem CID75414588
Molecular FormulaC14H13N3O3
Molecular Weight271.28 g/mol
Exact Mass271.10
IUPAC NameN-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide
SMILESNC(=O)Cc1ccc(NC(=O)c2ccc[nH]c2=O)cc1
InChIInChI=1S/C14H13N3O3/c15-12(18)8-9-3-5-10(6-4-9)17-14(20)11-2-1-7-16-13(11)19/h1-7H,8H2,(H2,15,18)(H,16,19)(H,17,20)
InChIKeyJSNVTYIDVKQNPY-UHFFFAOYSA-N
XLogP0.65
TPSA105.05 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.28
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-ethylphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 17476623
N-(4-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 42371486
N-(3,4-dichlorophenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 110692742
N-(3,5-dichlorophenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 110692745
N-[4-[2-(furan-2-carbonylamino)ethylcarbamoyl]phenyl]-2-oxo-1H-pyridine-3-carboxamide
CID 121062747
N-(3-chloro-4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 64787521
N-(3-bromo-4-iodophenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 114262173
N-[[4-(butanoylamino)phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 60516002
N-(3-iodophenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 60653882
N-(4-bromo-3-fluorophenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 65436030
N-(4-bromo-3-iodophenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 114259349
2-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 47248811

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide (CID 75414588) is N-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide is NC(=O)Cc1ccc(NC(=O)c2ccc[nH]c2=O)cc1.
What is the InChIKey of N-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is JSNVTYIDVKQNPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O3/c15-12(18)8-9-3-5-10(6-4-9)17-14(20)11-2-1-7-16-13(11)19/h1-7H,8H2,(H2,15,18)(H,16,19)(H,17,20).
What are the key properties of N-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide?
N-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 271.28 g/mol, XLogP of 0.65, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-amino-2-oxoethyl)phenyl]-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 75414588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).