6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide

C14H15N3O2 — CID 95976232

IUPAC6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)N[C@@H](C)c2ccccn2)c(=O)[nH]1
InChIInChI=1S/C14H15N3O2/c1-9-6-7-11(13(18)16-9)14(19)17-10(2)12-5-3-4-8-15-12/h3-8,10H,1-2H3,(H,16,18)(H,17,19)/t10-/m0/s1
InChIKeyDMPMLQGDIVDUII-JTQLQIEISA-N
MW257.29 g/mol
LogP1.57
Rot. Bonds3

About 6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide

6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide (PubChem CID 95976232) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide
PubChem CID95976232
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)N[C@@H](C)c2ccccn2)c(=O)[nH]1
InChIInChI=1S/C14H15N3O2/c1-9-6-7-11(13(18)16-9)14(19)17-10(2)12-5-3-4-8-15-12/h3-8,10H,1-2H3,(H,16,18)(H,17,19)/t10-/m0/s1
InChIKeyDMPMLQGDIVDUII-JTQLQIEISA-N
XLogP1.57
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-oxo-6-phenyl-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide
CID 95975984
2-(methylamino)-N-[(1R)-1-pyridin-2-ylethyl]benzamide
CID 81406697
3-hydroxy-2-methyl-N-(1-pyridin-2-ylethyl)benzamide
CID 82829719
2-chloro-N-[(1S)-1-pyridin-2-ylethyl]benzamide
CID 36804802
N-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 95976314
2-(ethylamino)-N-(1-pyridin-2-ylethyl)benzamide
CID 62168319
6-methyl-N-[(1S)-1-(5-methylthiophen-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
CID 95976841
5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)benzamide
CID 65307460
5-amino-N-(1-pyridin-2-ylethyl)-1H-pyrazole-4-carboxamide
CID 43524573
2-methyl-N-(1-pyridin-2-ylethyl)-5-sulfanylbenzamide
CID 107022791
4-tert-butyl-N-[(1S)-1-pyridin-2-ylethyl]benzamide
CID 35939821
3-hydroxy-N-(1-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 81443248

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide?
The IUPAC name of 6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide (CID 95976232) is 6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide is Cc1ccc(C(=O)N[C@@H](C)c2ccccn2)c(=O)[nH]1.
What is the InChIKey of 6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide?
The InChIKey is DMPMLQGDIVDUII-JTQLQIEISA-N. The full InChI is InChI=1S/C14H15N3O2/c1-9-6-7-11(13(18)16-9)14(19)17-10(2)12-5-3-4-8-15-12/h3-8,10H,1-2H3,(H,16,18)(H,17,19)/t10-/m0/s1.
What are the key properties of 6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide?
6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 1.57, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide is sourced from PubChem (CID 95976232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).