N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide

C21H18N4O2 — CID 109245547

IUPACN-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
SMILESCOc1ccc(C)cc1Nc1cncc(C(=O)Nc2ccccc2C#N)c1
InChIInChI=1S/C21H18N4O2/c1-14-7-8-20(27-2)19(9-14)24-17-10-16(12-23-13-17)21(26)25-18-6-4-3-5-15(18)11-22/h3-10,12-13,24H,1-2H3,(H,25,26)
InChIKeyQQJOHVMPOMSNOH-UHFFFAOYSA-N
MW358.40 g/mol
LogP4.27
Rot. Bonds5

About N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide

N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide (PubChem CID 109245547) has the molecular formula C21H18N4O2 and a molecular weight of 358.40 g/mol. Its IUPAC name is N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
PubChem CID109245547
Molecular FormulaC21H18N4O2
Molecular Weight358.40 g/mol
Exact Mass358.14
IUPAC NameN-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
SMILESCOc1ccc(C)cc1Nc1cncc(C(=O)Nc2ccccc2C#N)c1
InChIInChI=1S/C21H18N4O2/c1-14-7-8-20(27-2)19(9-14)24-17-10-16(12-23-13-17)21(26)25-18-6-4-3-5-15(18)11-22/h3-10,12-13,24H,1-2H3,(H,25,26)
InChIKeyQQJOHVMPOMSNOH-UHFFFAOYSA-N
XLogP4.27
TPSA87.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-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

5-(2-cyanoanilino)-N-(2,4-dimethylphenyl)pyridine-3-carboxamide
CID 109242712
N-(2-cyanophenyl)-5-(2-methylanilino)pyridine-3-carboxamide
CID 109241817
N-(2-cyanophenyl)-6-(2-methoxy-5-methylanilino)pyridazine-3-carboxamide
CID 109129563
N-(2-methoxyphenyl)-5-(4-methylanilino)pyridine-3-carboxamide
CID 109242131
N-(4-fluorophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
CID 109244246
N-(4-chlorophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
CID 109244574
N-(3-fluorophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
CID 109245541
4-(2-cyanoanilino)-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 109221872
5-(2-cyanoanilino)-N-(2,6-dimethylphenyl)pyridine-3-carboxamide
CID 109243164
5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide
CID 109222894
N-(4-acetamidophenyl)-5-(2-cyanoanilino)pyridine-3-carboxamide
CID 109245887
N-(2-cyanophenyl)-5-[(4-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232741

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide?
The IUPAC name of N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide (CID 109245547) is N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide is COc1ccc(C)cc1Nc1cncc(C(=O)Nc2ccccc2C#N)c1.
What is the InChIKey of N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide?
The InChIKey is QQJOHVMPOMSNOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O2/c1-14-7-8-20(27-2)19(9-14)24-17-10-16(12-23-13-17)21(26)25-18-6-4-3-5-15(18)11-22/h3-10,12-13,24H,1-2H3,(H,25,26).
What are the key properties of N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide?
N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide has a molecular weight of 358.40 g/mol, XLogP of 4.27, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109245547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).