N-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide

C18H13BrFN3O — CID 23632618

IUPACN-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Br)cc1)c1cccnc1Nc1cccc(F)c1
InChIInChI=1S/C18H13BrFN3O/c19-12-6-8-14(9-7-12)23-18(24)16-5-2-10-21-17(16)22-15-4-1-3-13(20)11-15/h1-11H,(H,21,22)(H,23,24)
InChIKeyFOMNINZIMCTAQQ-UHFFFAOYSA-N
MW386.22 g/mol
LogP4.98
Rot. Bonds4

About N-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide

N-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide (PubChem CID 23632618) has the molecular formula C18H13BrFN3O and a molecular weight of 386.22 g/mol. Its IUPAC name is N-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide
PubChem CID23632618
Molecular FormulaC18H13BrFN3O
Molecular Weight386.22 g/mol
Exact Mass385.02
IUPAC NameN-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Br)cc1)c1cccnc1Nc1cccc(F)c1
InChIInChI=1S/C18H13BrFN3O/c19-12-6-8-14(9-7-12)23-18(24)16-5-2-10-21-17(16)22-15-4-1-3-13(20)11-15/h1-11H,(H,21,22)(H,23,24)
InChIKeyFOMNINZIMCTAQQ-UHFFFAOYSA-N
XLogP4.98
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.22
LogP ≤ 54.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4-bromophenyl)-2-(3-fluoroanilino)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

Related Compounds

2-(3-bromoanilino)-N-(4-bromophenyl)pyridine-3-carboxamide
CID 23632626
2-(3-fluoroanilino)-N-(4-methylphenyl)pyridine-3-carboxamide
CID 23632400
2-(3-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 23632674
N-(4-bromophenyl)-2-(3-chloroanilino)pyridine-3-carboxamide
CID 23632629
N-(3-fluorophenyl)-2-(4-methylanilino)pyridine-3-carboxamide
CID 23632549
2-(3-fluoroanilino)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 23632897
N-(4-bromophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide
CID 23632625
N-(4-cyclopentylsulfanylphenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide
CID 60509420
2-(3-bromoanilino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
CID 23632949
N-[4-[3-(dimethylamino)propoxy]phenyl]-2-(3-fluoroanilino)pyridine-3-carboxamide
CID 86898718
N-(4-bromophenyl)-2-(4-propan-2-ylanilino)pyridine-3-carboxamide
CID 23632633
2-(3-fluoroanilino)-N-methoxypyridine-3-carboxamide
CID 47246328

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide?
The IUPAC name of N-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide (CID 23632618) is N-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide is O=C(Nc1ccc(Br)cc1)c1cccnc1Nc1cccc(F)c1.
What is the InChIKey of N-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide?
The InChIKey is FOMNINZIMCTAQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13BrFN3O/c19-12-6-8-14(9-7-12)23-18(24)16-5-2-10-21-17(16)22-15-4-1-3-13(20)11-15/h1-11H,(H,21,22)(H,23,24).
What are the key properties of N-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide?
N-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide has a molecular weight of 386.22 g/mol, XLogP of 4.98, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-2-(3-fluoroanilino)pyridine-3-carboxamide is sourced from PubChem (CID 23632618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).