2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide

C21H21N3O2 — CID 23040065

IUPAC2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
SMILESCCc1c(C(=O)Nc2ccccc2)c(=O)cc(C)n1Cc1cccnc1
InChIInChI=1S/C21H21N3O2/c1-3-18-20(21(26)23-17-9-5-4-6-10-17)19(25)12-15(2)24(18)14-16-8-7-11-22-13-16/h4-13H,3,14H2,1-2H3,(H,23,26)
InChIKeyNIYVNDLKPYAVKK-UHFFFAOYSA-N
MW347.42 g/mol
LogP3.41
Rot. Bonds5

About 2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide

2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide (PubChem CID 23040065) has the molecular formula C21H21N3O2 and a molecular weight of 347.42 g/mol. Its IUPAC name is 2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
PubChem CID23040065
Molecular FormulaC21H21N3O2
Molecular Weight347.42 g/mol
Exact Mass347.16
IUPAC Name2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
SMILESCCc1c(C(=O)Nc2ccccc2)c(=O)cc(C)n1Cc1cccnc1
InChIInChI=1S/C21H21N3O2/c1-3-18-20(21(26)23-17-9-5-4-6-10-17)19(25)12-15(2)24(18)14-16-8-7-11-22-13-16/h4-13H,3,14H2,1-2H3,(H,23,26)
InChIKeyNIYVNDLKPYAVKK-UHFFFAOYSA-N
XLogP3.41
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-diethyl-4-oxo-N-phenyl-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 23037873
6-methyl-N-(2-methylphenyl)-4-oxo-2-pentyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 23040324
2-butyl-N-(2-chlorophenyl)-6-methyl-4-oxo-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 23040327
4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 91310443
6-methyl-4-oxo-N-phenyl-2-pyridin-4-yl-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 23040319
6-methyl-1-[(4-methylphenyl)methyl]-4-oxo-N-phenyl-2-pyridin-4-ylpyridine-3-carboxamide
CID 23040715
1-benzyl-2-butyl-6-ethyl-4-oxo-N-phenylpyridine-3-carboxamide
CID 23040376
1-benzyl-2-(2-chlorophenyl)-6-methyl-4-oxo-N-phenylpyridine-3-carboxamide
CID 14277848
1-benzyl-2-(furan-2-yl)-6-methyl-4-oxo-N-phenylpyridine-3-carboxamide
CID 14252505
2-(2-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methyl-4-oxo-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 23040706
N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide
CID 23040750
2-butyl-6-ethyl-1-[(4-methylphenyl)methyl]-4-oxo-N-phenylpyridine-3-carboxamide
CID 23040020

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide (CID 23040065) is 2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide is CCc1c(C(=O)Nc2ccccc2)c(=O)cc(C)n1Cc1cccnc1.
What is the InChIKey of 2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
The InChIKey is NIYVNDLKPYAVKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O2/c1-3-18-20(21(26)23-17-9-5-4-6-10-17)19(25)12-15(2)24(18)14-16-8-7-11-22-13-16/h4-13H,3,14H2,1-2H3,(H,23,26).
What are the key properties of 2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide has a molecular weight of 347.42 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 23040065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).