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

C19H16FN3O — CID 23632549

IUPACN-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide
SMILESCc1ccc(Nc2ncccc2C(=O)Nc2cccc(F)c2)cc1
InChIInChI=1S/C19H16FN3O/c1-13-7-9-15(10-8-13)22-18-17(6-3-11-21-18)19(24)23-16-5-2-4-14(20)12-16/h2-12H,1H3,(H,21,22)(H,23,24)
InChIKeyFEQVOUWCPNCGRF-UHFFFAOYSA-N
MW321.36 g/mol
LogP4.53
Rot. Bonds4

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

N-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide (PubChem CID 23632549) has the molecular formula C19H16FN3O and a molecular weight of 321.36 g/mol. Its IUPAC name is N-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide
PubChem CID23632549
Molecular FormulaC19H16FN3O
Molecular Weight321.36 g/mol
Exact Mass321.13
IUPAC NameN-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide
SMILESCc1ccc(Nc2ncccc2C(=O)Nc2cccc(F)c2)cc1
InChIInChI=1S/C19H16FN3O/c1-13-7-9-15(10-8-13)22-18-17(6-3-11-21-18)19(24)23-16-5-2-4-14(20)12-16/h2-12H,1H3,(H,21,22)(H,23,24)
InChIKeyFEQVOUWCPNCGRF-UHFFFAOYSA-N
XLogP4.53
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.36
LogP ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-fluoroanilino)-N-(4-methylphenyl)pyridine-3-carboxamide
CID 23632400
2-(3-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 23632674
2-anilino-N-(4-methylphenyl)pyridine-3-carboxamide
CID 23632392
N-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide
CID 23632618
N-(3-chlorophenyl)-2-(4-fluoroanilino)pyridine-3-carboxamide
CID 23632835
N-[3-[(dimethylamino)methyl]phenyl]-2-(3-fluoroanilino)pyridine-3-carboxamide
CID 51119906
2-(3-fluoroanilino)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 23632897
2-(3-fluoroanilino)-N-methoxypyridine-3-carboxamide
CID 47246328
2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 23632686
N-[4-[3-(dimethylamino)propoxy]phenyl]-2-(3-fluoroanilino)pyridine-3-carboxamide
CID 86898718
N-(4-cyclopentylsulfanylphenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide
CID 60509420
N-(2-anilino-3-pyridinyl)-2-(4-fluoroanilino)pyridine-3-carboxamide
CID 118724324

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide?
The IUPAC name of N-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide (CID 23632549) is N-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide is Cc1ccc(Nc2ncccc2C(=O)Nc2cccc(F)c2)cc1.
What is the InChIKey of N-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide?
The InChIKey is FEQVOUWCPNCGRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O/c1-13-7-9-15(10-8-13)22-18-17(6-3-11-21-18)19(24)23-16-5-2-4-14(20)12-16/h2-12H,1H3,(H,21,22)(H,23,24).
What are the key properties of N-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide?
N-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide has a molecular weight of 321.36 g/mol, XLogP of 4.53, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide is sourced from PubChem (CID 23632549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).