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

C23H25N3O2 — CID 26337612

IUPACN-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
SMILESCCNC(=O)c1c(CCc2ccccc2)n(Cc2ccccn2)c(C)cc1=O
InChIInChI=1S/C23H25N3O2/c1-3-24-23(28)22-20(13-12-18-9-5-4-6-10-18)26(17(2)15-21(22)27)16-19-11-7-8-14-25-19/h4-11,14-15H,3,12-13,16H2,1-2H3,(H,24,28)
InChIKeyXTYNKPPUYQDHMK-UHFFFAOYSA-N
MW375.47 g/mol
LogP3.13
Rot. Bonds7

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

N-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide (PubChem CID 26337612) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is N-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
PubChem CID26337612
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC NameN-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
SMILESCCNC(=O)c1c(CCc2ccccc2)n(Cc2ccccn2)c(C)cc1=O
InChIInChI=1S/C23H25N3O2/c1-3-24-23(28)22-20(13-12-18-9-5-4-6-10-18)26(17(2)15-21(22)27)16-19-11-7-8-14-25-19/h4-11,14-15H,3,12-13,16H2,1-2H3,(H,24,28)
InChIKeyXTYNKPPUYQDHMK-UHFFFAOYSA-N
XLogP3.13
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxyethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 42484940
6-methyl-4-oxo-2-(2-phenylethyl)-N-propan-2-yl-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 42472455
6-methyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 45235668
6-methyl-3-[(3S)-3-methylpiperidine-1-carbonyl]-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridin-4-one
CID 42483316
2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 26344453
N-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 118756559
N-[[(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]methyl]-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 42484125
2-ethyl-1-[(2-methoxyphenyl)methyl]-6-methyl-4-oxo-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 42433021
6-methyl-2-[(2-methylphenyl)methyl]-N-(1,2-oxazol-3-ylmethyl)-4-oxo-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 42407329
N-(2-chlorophenyl)-6-methyl-2-(2-methylpropyl)-4-oxo-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 23040152
methyl 5-methyl-2-propyl-1-(pyridin-2-ylmethyl)pyrrole-3-carboxylate
CID 11608760
2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 23040065

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of N-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide (CID 26337612) is N-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for N-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide is CCNC(=O)c1c(CCc2ccccc2)n(Cc2ccccn2)c(C)cc1=O.
What is the InChIKey of N-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide?
The InChIKey is XTYNKPPUYQDHMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-3-24-23(28)22-20(13-12-18-9-5-4-6-10-18)26(17(2)15-21(22)27)16-19-11-7-8-14-25-19/h4-11,14-15H,3,12-13,16H2,1-2H3,(H,24,28).
What are the key properties of N-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide?
N-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide has a molecular weight of 375.47 g/mol, XLogP of 3.13, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 26337612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).