N-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide

C16H15N3O2 — CID 110864709

IUPACN-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
SMILESCc1cc(C)n(C)c(=O)c1C(=O)Nc1ccccc1C#N
InChIInChI=1S/C16H15N3O2/c1-10-8-11(2)19(3)16(21)14(10)15(20)18-13-7-5-4-6-12(13)9-17/h4-8H,1-3H3,(H,18,20)
InChIKeyZWZMETHKJCTVJO-UHFFFAOYSA-N
MW281.31 g/mol
LogP2.13
Rot. Bonds2

About N-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide

N-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide (PubChem CID 110864709) has the molecular formula C16H15N3O2 and a molecular weight of 281.31 g/mol. Its IUPAC name is N-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
PubChem CID110864709
Molecular FormulaC16H15N3O2
Molecular Weight281.31 g/mol
Exact Mass281.12
IUPAC NameN-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
SMILESCc1cc(C)n(C)c(=O)c1C(=O)Nc1ccccc1C#N
InChIInChI=1S/C16H15N3O2/c1-10-8-11(2)19(3)16(21)14(10)15(20)18-13-7-5-4-6-12(13)9-17/h4-8H,1-3H3,(H,18,20)
InChIKeyZWZMETHKJCTVJO-UHFFFAOYSA-N
XLogP2.13
TPSA74.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-cyanophenyl)-1,3-dimethyl-2-oxobenzimidazole-5-carboxamide
CID 110765482
2-amino-N-(2-cyanophenyl)-6-methylbenzamide
CID 16781189
1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide
CID 131943063
N-(2-cyanophenyl)-4-methylbenzamide
CID 2542047
1,4,6-trimethyl-2-oxo-N-(4-phenoxyphenyl)pyridine-3-carboxamide
CID 110862650
3-benzamido-N-(2-cyanophenyl)-4-methylbenzamide
CID 17226453
N-(2-cyanophenyl)-3-(3-methyl-2-oxo-1-pyridinyl)propanamide
CID 63172291
4-N-(2-cyanophenyl)-1-N-(3,4-dimethylphenyl)benzene-1,4-dicarboxamide
CID 109049652
N-(2-cyanophenyl)-4-hydroxy-2-oxo-1-propylquinoline-3-carboxamide
CID 54678204
N-(2-cyanophenyl)-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide
CID 110864734
N-(2-cyanophenyl)-5-methyl-1-phenylpyrazole-3-carboxamide
CID 71684163
N-(2-cyanophenyl)-2-(methylamino)acetamide
CID 24697085

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
The IUPAC name of N-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide (CID 110864709) is N-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide is Cc1cc(C)n(C)c(=O)c1C(=O)Nc1ccccc1C#N.
What is the InChIKey of N-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
The InChIKey is ZWZMETHKJCTVJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-10-8-11(2)19(3)16(21)14(10)15(20)18-13-7-5-4-6-12(13)9-17/h4-8H,1-3H3,(H,18,20).
What are the key properties of N-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
N-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide has a molecular weight of 281.31 g/mol, XLogP of 2.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 110864709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).