2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide

C19H16FN3O — CID 23632686

IUPAC2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
SMILESCc1cccc(NC(=O)c2cccnc2Nc2ccccc2F)c1
InChIInChI=1S/C19H16FN3O/c1-13-6-4-7-14(12-13)22-19(24)15-8-5-11-21-18(15)23-17-10-3-2-9-16(17)20/h2-12H,1H3,(H,21,23)(H,22,24)
InChIKeyOCTSZLAZVSCSJG-UHFFFAOYSA-N
MW321.36 g/mol
LogP4.53
Rot. Bonds4

About 2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide

2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide (PubChem CID 23632686) has the molecular formula C19H16FN3O and a molecular weight of 321.36 g/mol. Its IUPAC name is 2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
PubChem CID23632686
Molecular FormulaC19H16FN3O
Molecular Weight321.36 g/mol
Exact Mass321.13
IUPAC Name2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
SMILESCc1cccc(NC(=O)c2cccnc2Nc2ccccc2F)c1
InChIInChI=1S/C19H16FN3O/c1-13-6-4-7-14(12-13)22-19(24)15-8-5-11-21-18(15)23-17-10-3-2-9-16(17)20/h2-12H,1H3,(H,21,23)(H,22,24)
InChIKeyOCTSZLAZVSCSJG-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

N-(3-bromophenyl)-2-(2-fluoroanilino)pyridine-3-carboxamide
CID 23632769
2-(2-fluoroanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 23632516
2-(3-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 23632674
N-(2-chlorophenyl)-2-(2-fluoroanilino)pyridine-3-carboxamide
CID 23632658
2-(2-bromoanilino)-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 23632878
2-(2-methylanilino)-N-phenylpyridine-3-carboxamide
CID 23632378
N-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide
CID 23632549
N-(2,6-dimethylphenyl)-2-(3-methylanilino)pyridine-3-carboxamide
CID 23633002
2-(3-fluoroanilino)-N-(4-methylphenyl)pyridine-3-carboxamide
CID 23632400
2-(2-fluoroanilino)-N-(1-methylpyrazol-3-yl)pyridine-3-carboxamide
CID 51335853
6-N-(2-fluorophenyl)-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide
CID 109100120
N-(2-amino-2-methylpropyl)-2-(2-fluoroanilino)pyridine-3-carboxamide
CID 119625766

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide (CID 23632686) is 2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide is Cc1cccc(NC(=O)c2cccnc2Nc2ccccc2F)c1.
What is the InChIKey of 2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide?
The InChIKey is OCTSZLAZVSCSJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O/c1-13-6-4-7-14(12-13)22-19(24)15-8-5-11-21-18(15)23-17-10-3-2-9-16(17)20/h2-12H,1H3,(H,21,23)(H,22,24).
What are the key properties of 2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide?
2-(2-fluoroanilino)-N-(3-methylphenyl)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 2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 23632686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).