N-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide

C19H15ClFN3O2 — CID 23632811

IUPACN-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide
SMILESCOc1cccc(Nc2ncccc2C(=O)Nc2ccc(F)c(Cl)c2)c1
InChIInChI=1S/C19H15ClFN3O2/c1-26-14-5-2-4-12(10-14)23-18-15(6-3-9-22-18)19(25)24-13-7-8-17(21)16(20)11-13/h2-11H,1H3,(H,22,23)(H,24,25)
InChIKeyITONPGZZTZYUEY-UHFFFAOYSA-N
MW371.80 g/mol
LogP4.88
Rot. Bonds5

About N-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide

N-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide (PubChem CID 23632811) has the molecular formula C19H15ClFN3O2 and a molecular weight of 371.80 g/mol. Its IUPAC name is N-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide
PubChem CID23632811
Molecular FormulaC19H15ClFN3O2
Molecular Weight371.80 g/mol
Exact Mass371.08
IUPAC NameN-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide
SMILESCOc1cccc(Nc2ncccc2C(=O)Nc2ccc(F)c(Cl)c2)c1
InChIInChI=1S/C19H15ClFN3O2/c1-26-14-5-2-4-12(10-14)23-18-15(6-3-9-22-18)19(25)24-13-7-8-17(21)16(20)11-13/h2-11H,1H3,(H,22,23)(H,24,25)
InChIKeyITONPGZZTZYUEY-UHFFFAOYSA-N
XLogP4.88
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.80
LogP ≤ 54.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide?
The IUPAC name of N-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide (CID 23632811) is N-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide is COc1cccc(Nc2ncccc2C(=O)Nc2ccc(F)c(Cl)c2)c1.
What is the InChIKey of N-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide?
The InChIKey is ITONPGZZTZYUEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClFN3O2/c1-26-14-5-2-4-12(10-14)23-18-15(6-3-9-22-18)19(25)24-13-7-8-17(21)16(20)11-13/h2-11H,1H3,(H,22,23)(H,24,25).
What are the key properties of N-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide?
N-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide has a molecular weight of 371.80 g/mol, XLogP of 4.88, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-fluorophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide is sourced from PubChem (CID 23632811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).