N-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide

C22H19N3O4 — CID 7599376

IUPACN-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide
SMILESCOc1cc(Cn2cccc(C(=O)Nc3ccccc3C#N)c2=O)cc(OC)c1
InChIInChI=1S/C22H19N3O4/c1-28-17-10-15(11-18(12-17)29-2)14-25-9-5-7-19(22(25)27)21(26)24-20-8-4-3-6-16(20)13-23/h3-12H,14H2,1-2H3,(H,24,26)
InChIKeyCSKJDPWJKFVZFL-UHFFFAOYSA-N
MW389.41 g/mol
LogP3.04
Rot. Bonds6

About N-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide

N-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide (PubChem CID 7599376) has the molecular formula C22H19N3O4 and a molecular weight of 389.41 g/mol. Its IUPAC name is N-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide
PubChem CID7599376
Molecular FormulaC22H19N3O4
Molecular Weight389.41 g/mol
Exact Mass389.14
IUPAC NameN-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide
SMILESCOc1cc(Cn2cccc(C(=O)Nc3ccccc3C#N)c2=O)cc(OC)c1
InChIInChI=1S/C22H19N3O4/c1-28-17-10-15(11-18(12-17)29-2)14-25-9-5-7-19(22(25)27)21(26)24-20-8-4-3-6-16(20)13-23/h3-12H,14H2,1-2H3,(H,24,26)
InChIKeyCSKJDPWJKFVZFL-UHFFFAOYSA-N
XLogP3.04
TPSA93.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.41
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-carbamoylphenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7599441
1-[(4-chlorophenyl)methyl]-N-(2-cyanophenyl)-2-oxopyridine-3-carboxamide
CID 7598034
N-(2,4-difluorophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7599382
N-(2-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 110382898
N-(3-chloro-4-fluorophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7599387
N-(2-cyanophenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide
CID 110382865
N-(4-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 110382606
N-(2,4-dimethylphenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 110382915
N-(2,4-dimethoxyphenyl)-1-[(4-ethylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 110382645
1-[(4-chlorophenyl)methyl]-N-(2,5-dimethoxyphenyl)-2-oxopyridine-3-carboxamide
CID 7598073
1-[(3-chlorophenyl)methoxy]-N-(2-cyanophenyl)-2-oxopyridine-3-carboxamide
CID 110382844
1-[(4-fluorophenyl)methyl]-N-(4-methoxyphenyl)-2-oxopyridine-3-carboxamide
CID 7597717

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide?
The IUPAC name of N-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide (CID 7599376) is N-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide is COc1cc(Cn2cccc(C(=O)Nc3ccccc3C#N)c2=O)cc(OC)c1.
What is the InChIKey of N-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide?
The InChIKey is CSKJDPWJKFVZFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O4/c1-28-17-10-15(11-18(12-17)29-2)14-25-9-5-7-19(22(25)27)21(26)24-20-8-4-3-6-16(20)13-23/h3-12H,14H2,1-2H3,(H,24,26).
What are the key properties of N-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide?
N-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide has a molecular weight of 389.41 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 7599376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).