4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide

C17H19N3O2 — CID 75450141

IUPAC4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide
SMILESCc1cc[nH]c(=O)c1C(=O)Nc1cccc(N2CCCC2)c1
InChIInChI=1S/C17H19N3O2/c1-12-7-8-18-16(21)15(12)17(22)19-13-5-4-6-14(11-13)20-9-2-3-10-20/h4-8,11H,2-3,9-10H2,1H3,(H,18,21)(H,19,22)
InChIKeyDSTKLALJIGLDCW-UHFFFAOYSA-N
MW297.36 g/mol
LogP2.54
Rot. Bonds3

About 4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide

4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide (PubChem CID 75450141) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is 4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide
PubChem CID75450141
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC Name4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide
SMILESCc1cc[nH]c(=O)c1C(=O)Nc1cccc(N2CCCC2)c1
InChIInChI=1S/C17H19N3O2/c1-12-7-8-18-16(21)15(12)17(22)19-13-5-4-6-14(11-13)20-9-2-3-10-20/h4-8,11H,2-3,9-10H2,1H3,(H,18,21)(H,19,22)
InChIKeyDSTKLALJIGLDCW-UHFFFAOYSA-N
XLogP2.54
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-fluorophenyl)-4-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 110409928
N-(3-methoxyphenyl)-4-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 110650244
4-[2-(3-chlorophenyl)ethylamino]-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide
CID 25191767
2-(methylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 54862520
6,8-dimethyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-quinoline-3-carboxamide
CID 110422824
N-[3-(azepan-1-yl)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 120704662
N-(3-morpholin-4-ylphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 71938580
methyl N-(3-piperidin-1-ylphenyl)carbamate
CID 110362130
2-methyl-N-(3-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide
CID 166198478
N-(3-pyrrolidin-1-ylphenyl)piperidine-4-carboxamide
CID 60928576
6-oxo-N-(3-pyrrolidin-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 60934157
2-methyl-N-(3-piperidin-1-ylphenyl)propanamide
CID 47379438

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide?
The IUPAC name of 4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide (CID 75450141) is 4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for 4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for 4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide is Cc1cc[nH]c(=O)c1C(=O)Nc1cccc(N2CCCC2)c1.
What is the InChIKey of 4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide?
The InChIKey is DSTKLALJIGLDCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-12-7-8-18-16(21)15(12)17(22)19-13-5-4-6-14(11-13)20-9-2-3-10-20/h4-8,11H,2-3,9-10H2,1H3,(H,18,21)(H,19,22).
What are the key properties of 4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide?
4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide has a molecular weight of 297.36 g/mol, XLogP of 2.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-oxo-N-(3-pyrrolidin-1-ylphenyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 75450141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).