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

C19H15ClFN3O — CID 109220598

IUPAC4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide
SMILESCc1ccc(Nc2ccnc(C(=O)Nc3ccccc3F)c2)cc1Cl
InChIInChI=1S/C19H15ClFN3O/c1-12-6-7-13(10-15(12)20)23-14-8-9-22-18(11-14)19(25)24-17-5-3-2-4-16(17)21/h2-11H,1H3,(H,22,23)(H,24,25)
InChIKeyAHDHLDIZDARPLK-UHFFFAOYSA-N
MW355.80 g/mol
LogP5.18
Rot. Bonds4

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

4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide (PubChem CID 109220598) has the molecular formula C19H15ClFN3O and a molecular weight of 355.80 g/mol. Its IUPAC name is 4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide
PubChem CID109220598
Molecular FormulaC19H15ClFN3O
Molecular Weight355.80 g/mol
Exact Mass355.09
IUPAC Name4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide
SMILESCc1ccc(Nc2ccnc(C(=O)Nc3ccccc3F)c2)cc1Cl
InChIInChI=1S/C19H15ClFN3O/c1-12-6-7-13(10-15(12)20)23-14-8-9-22-18(11-14)19(25)24-17-5-3-2-4-16(17)21/h2-11H,1H3,(H,22,23)(H,24,25)
InChIKeyAHDHLDIZDARPLK-UHFFFAOYSA-N
XLogP5.18
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.80
LogP ≤ 55.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluorophenyl)-4-(4-methoxyanilino)pyridine-2-carboxamide
CID 109220605
2-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyrimidine-5-carboxamide
CID 109268328
N-(2-fluorophenyl)-4-(propylamino)pyridine-2-carboxamide
CID 62166215
N-(2-fluorophenyl)-4-hydrazinylpyridine-2-carboxamide
CID 62249933
N-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide
CID 109220710
N-(2-chlorophenyl)-4-(2,6-difluoroanilino)pyridine-2-carboxamide
CID 109220893
4-N-(3,4-dimethylphenyl)-2-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109091879
N-(2-fluorophenyl)-4-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 109220614
N-(2-bromophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide
CID 109220697
4-(3-chloro-4-methylanilino)-N-(2,4-dimethoxyphenyl)pyridine-2-carboxamide
CID 109221271
4-N-(3-chloro-4-fluorophenyl)-2-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109092643
N-(2,6-difluorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide
CID 109220720

Frequently Asked Questions

What is the IUPAC name of 4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide?
The IUPAC name of 4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide (CID 109220598) is 4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide is Cc1ccc(Nc2ccnc(C(=O)Nc3ccccc3F)c2)cc1Cl.
What is the InChIKey of 4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide?
The InChIKey is AHDHLDIZDARPLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClFN3O/c1-12-6-7-13(10-15(12)20)23-14-8-9-22-18(11-14)19(25)24-17-5-3-2-4-16(17)21/h2-11H,1H3,(H,22,23)(H,24,25).
What are the key properties of 4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide?
4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide has a molecular weight of 355.80 g/mol, XLogP of 5.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109220598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).