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

C19H15ClFN3O2 — CID 109177807

IUPAC2-(3-chloro-4-methoxyanilino)-N-(3-fluorophenyl)pyridine-4-carboxamide
SMILESCOc1ccc(Nc2cc(C(=O)Nc3cccc(F)c3)ccn2)cc1Cl
InChIInChI=1S/C19H15ClFN3O2/c1-26-17-6-5-15(11-16(17)20)23-18-9-12(7-8-22-18)19(25)24-14-4-2-3-13(21)10-14/h2-11H,1H3,(H,22,23)(H,24,25)
InChIKeyXQOZWYWMOCEBTA-UHFFFAOYSA-N
MW371.80 g/mol
LogP4.88
Rot. Bonds5

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

2-(3-chloro-4-methoxyanilino)-N-(3-fluorophenyl)pyridine-4-carboxamide (PubChem CID 109177807) has the molecular formula C19H15ClFN3O2 and a molecular weight of 371.80 g/mol. Its IUPAC name is 2-(3-chloro-4-methoxyanilino)-N-(3-fluorophenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(3-chloro-4-methoxyanilino)-N-(3-fluorophenyl)pyridine-4-carboxamide
PubChem CID109177807
Molecular FormulaC19H15ClFN3O2
Molecular Weight371.80 g/mol
Exact Mass371.08
IUPAC Name2-(3-chloro-4-methoxyanilino)-N-(3-fluorophenyl)pyridine-4-carboxamide
SMILESCOc1ccc(Nc2cc(C(=O)Nc3cccc(F)c3)ccn2)cc1Cl
InChIInChI=1S/C19H15ClFN3O2/c1-26-17-6-5-15(11-16(17)20)23-18-9-12(7-8-22-18)19(25)24-14-4-2-3-13(21)10-14/h2-11H,1H3,(H,22,23)(H,24,25)
InChIKeyXQOZWYWMOCEBTA-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

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Related Compounds

N-(3-chloro-4-methoxyphenyl)-2-(3-methylanilino)pyridine-4-carboxamide
CID 109176255
N-(3-chloro-4-methylphenyl)-2-(3-fluoroanilino)pyridine-4-carboxamide
CID 109177698
2-(3-chloro-4-methoxyanilino)-N-(3-cyanophenyl)pyridine-4-carboxamide
CID 109177812
2-(3-chloro-4-methoxyanilino)-N-(2,4-difluorophenyl)pyridine-4-carboxamide
CID 109177809
N-(4-acetylphenyl)-2-(3-chloro-4-methoxyanilino)pyridine-4-carboxamide
CID 109177805
N-(3-chloro-4-methoxyphenyl)-6-(3-fluoroanilino)-2-methylpyrimidine-4-carboxamide
CID 112850391
N-(3-chloro-4-methoxyphenyl)-3-[[5-(4-fluorophenyl)pyrimidin-2-yl]amino]benzamide
CID 50826642
2-amino-N-(3-chloro-4-methoxyphenyl)pyridine-4-carboxamide
CID 55043717
N-(3,4-difluorophenyl)-2-(3,4-dimethoxyanilino)pyridine-4-carboxamide
CID 109178406
4-N-(3-chloro-4-methoxyphenyl)-2-N-phenylpyridine-2,4-dicarboxamide
CID 109090928
N-(4-chlorophenyl)-2-(3,4-dimethoxyanilino)pyridine-4-carboxamide
CID 109177506
2-(3-chloro-4-fluoroanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 46283339

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-4-methoxyanilino)-N-(3-fluorophenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(3-chloro-4-methoxyanilino)-N-(3-fluorophenyl)pyridine-4-carboxamide (CID 109177807) is 2-(3-chloro-4-methoxyanilino)-N-(3-fluorophenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(3-chloro-4-methoxyanilino)-N-(3-fluorophenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(3-chloro-4-methoxyanilino)-N-(3-fluorophenyl)pyridine-4-carboxamide is COc1ccc(Nc2cc(C(=O)Nc3cccc(F)c3)ccn2)cc1Cl.
What is the InChIKey of 2-(3-chloro-4-methoxyanilino)-N-(3-fluorophenyl)pyridine-4-carboxamide?
The InChIKey is XQOZWYWMOCEBTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClFN3O2/c1-26-17-6-5-15(11-16(17)20)23-18-9-12(7-8-22-18)19(25)24-14-4-2-3-13(21)10-14/h2-11H,1H3,(H,22,23)(H,24,25).
What are the key properties of 2-(3-chloro-4-methoxyanilino)-N-(3-fluorophenyl)pyridine-4-carboxamide?
2-(3-chloro-4-methoxyanilino)-N-(3-fluorophenyl)pyridine-4-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 2-(3-chloro-4-methoxyanilino)-N-(3-fluorophenyl)pyridine-4-carboxamide is sourced from PubChem (CID 109177807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).