4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide

C19H16ClN3O2 — CID 109218768

IUPAC4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide
SMILESCOc1ccc(Nc2ccnc(C(=O)Nc3ccccc3)c2)cc1Cl
InChIInChI=1S/C19H16ClN3O2/c1-25-18-8-7-14(11-16(18)20)22-15-9-10-21-17(12-15)19(24)23-13-5-3-2-4-6-13/h2-12H,1H3,(H,21,22)(H,23,24)
InChIKeyCQKTVXCRWAPKKK-UHFFFAOYSA-N
MW353.81 g/mol
LogP4.74
Rot. Bonds5

About 4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide

4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide (PubChem CID 109218768) has the molecular formula C19H16ClN3O2 and a molecular weight of 353.81 g/mol. Its IUPAC name is 4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide
PubChem CID109218768
Molecular FormulaC19H16ClN3O2
Molecular Weight353.81 g/mol
Exact Mass353.09
IUPAC Name4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide
SMILESCOc1ccc(Nc2ccnc(C(=O)Nc3ccccc3)c2)cc1Cl
InChIInChI=1S/C19H16ClN3O2/c1-25-18-8-7-14(11-16(18)20)22-15-9-10-21-17(12-15)19(24)23-13-5-3-2-4-6-13/h2-12H,1H3,(H,21,22)(H,23,24)
InChIKeyCQKTVXCRWAPKKK-UHFFFAOYSA-N
XLogP4.74
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.81
LogP ≤ 54.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-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

4-(4-chloroanilino)-N-(3-chloro-4-methoxyphenyl)pyridine-2-carboxamide
CID 109221059
4-N-(3-chloro-4-methoxyphenyl)-2-N-phenylpyridine-2,4-dicarboxamide
CID 109090928
N-(3-chloro-4-methoxyphenyl)-4-(4-methylanilino)pyridine-2-carboxamide
CID 109219289
4-(3-chloro-4-methoxyanilino)-N-(4-ethoxyphenyl)pyridine-2-carboxamide
CID 109221380
4-(3-chloro-4-methoxyanilino)-N-(3-cyanophenyl)pyridine-2-carboxamide
CID 109221390
6-(3-chloro-4-methoxyanilino)-N-phenylpyrimidine-4-carboxamide
CID 109355828
4-(3-chloro-4-methoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 109221381
4-(3-methoxyanilino)-N-phenylpyridine-2-carboxamide
CID 109218773
4-(3-chloro-4-methoxyanilino)-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 109205769
4-(4-methylanilino)-N-phenylpyridine-2-carboxamide
CID 109218739
4-(3,4-dimethoxyanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109220745
N-phenyl-4-(4-propan-2-ylanilino)pyridine-2-carboxamide
CID 109218754

Frequently Asked Questions

What is the IUPAC name of 4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide?
The IUPAC name of 4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide (CID 109218768) is 4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide.
What is the SMILES notation for 4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide?
The canonical SMILES for 4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide is COc1ccc(Nc2ccnc(C(=O)Nc3ccccc3)c2)cc1Cl.
What is the InChIKey of 4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide?
The InChIKey is CQKTVXCRWAPKKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN3O2/c1-25-18-8-7-14(11-16(18)20)22-15-9-10-21-17(12-15)19(24)23-13-5-3-2-4-6-13/h2-12H,1H3,(H,21,22)(H,23,24).
What are the key properties of 4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide?
4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide has a molecular weight of 353.81 g/mol, XLogP of 4.74, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chloro-4-methoxyanilino)-N-phenylpyridine-2-carboxamide is sourced from PubChem (CID 109218768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).