5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide

C15H15N3O2 — CID 17079488

IUPAC5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide
SMILESCC1=C(C#N)C(C(=O)Nc2ccc(C)cc2)CC(=O)N1
InChIInChI=1S/C15H15N3O2/c1-9-3-5-11(6-4-9)18-15(20)12-7-14(19)17-10(2)13(12)8-16/h3-6,12H,7H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyRAKGHRNTBBHMIY-UHFFFAOYSA-N
MW269.30 g/mol
LogP1.87
Rot. Bonds2

About 5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide

5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide (PubChem CID 17079488) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is 5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide.

Molecular Properties

Compound Name5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide
PubChem CID17079488
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide
SMILESCC1=C(C#N)C(C(=O)Nc2ccc(C)cc2)CC(=O)N1
InChIInChI=1S/C15H15N3O2/c1-9-3-5-11(6-4-9)18-15(20)12-7-14(19)17-10(2)13(12)8-16/h3-6,12H,7H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyRAKGHRNTBBHMIY-UHFFFAOYSA-N
XLogP1.87
TPSA81.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide?
The IUPAC name of 5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide (CID 17079488) is 5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide.
What is the SMILES notation for 5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide?
The canonical SMILES for 5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide is CC1=C(C#N)C(C(=O)Nc2ccc(C)cc2)CC(=O)N1.
What is the InChIKey of 5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide?
The InChIKey is RAKGHRNTBBHMIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-9-3-5-11(6-4-9)18-15(20)12-7-14(19)17-10(2)13(12)8-16/h3-6,12H,7H2,1-2H3,(H,17,19)(H,18,20).
What are the key properties of 5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide?
5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide has a molecular weight of 269.30 g/mol, XLogP of 1.87, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-4-carboxamide is sourced from PubChem (CID 17079488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).