6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide

C18H14BrN3O — CID 109162087

IUPAC6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide
SMILESO=C(Nc1cccc(Br)c1)c1ccc(Nc2ccccc2)nc1
InChIInChI=1S/C18H14BrN3O/c19-14-5-4-8-16(11-14)22-18(23)13-9-10-17(20-12-13)21-15-6-2-1-3-7-15/h1-12H,(H,20,21)(H,22,23)
InChIKeyMBVAJKSOYMNMFL-UHFFFAOYSA-N
MW368.23 g/mol
LogP4.84
Rot. Bonds4

About 6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide

6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide (PubChem CID 109162087) has the molecular formula C18H14BrN3O and a molecular weight of 368.23 g/mol. Its IUPAC name is 6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide
PubChem CID109162087
Molecular FormulaC18H14BrN3O
Molecular Weight368.23 g/mol
Exact Mass367.03
IUPAC Name6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide
SMILESO=C(Nc1cccc(Br)c1)c1ccc(Nc2ccccc2)nc1
InChIInChI=1S/C18H14BrN3O/c19-14-5-4-8-16(11-14)22-18(23)13-9-10-17(20-12-13)21-15-6-2-1-3-7-15/h1-12H,(H,20,21)(H,22,23)
InChIKeyMBVAJKSOYMNMFL-UHFFFAOYSA-N
XLogP4.84
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.23
LogP ≤ 54.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide
CID 62248318
6-(3-bromoanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109163992
N-(3-bromophenyl)-6-(cyclopentylamino)pyridine-3-carboxamide
CID 109152213
6-(3,5-dichloroanilino)-N-phenylpyridine-3-carboxamide
CID 109162127
6-(3-bromoanilino)-N-cyclopentylpyridine-3-carboxamide
CID 109152271
N-(3-acetamidophenyl)-6-(3,5-dimethylanilino)pyridine-3-carboxamide
CID 109162684
N-(3-acetamidophenyl)-6-(4-methylanilino)pyridine-3-carboxamide
CID 109162266
6-(3-acetamidoanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109162236
3-benzamido-N-(3-bromophenyl)benzamide
CID 1304486
methyl 3-[[6-(4-methylanilino)pyridine-3-carbonyl]amino]benzoate
CID 109162269
N-(3-acetylphenyl)-6-(4-ethylanilino)pyridine-3-carboxamide
CID 109162858
N-(3-bromophenyl)-6-[3-(dimethylamino)propylamino]pyridine-3-carboxamide
CID 109154345

Frequently Asked Questions

What is the IUPAC name of 6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide?
The IUPAC name of 6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide (CID 109162087) is 6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide is O=C(Nc1cccc(Br)c1)c1ccc(Nc2ccccc2)nc1.
What is the InChIKey of 6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide?
The InChIKey is MBVAJKSOYMNMFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14BrN3O/c19-14-5-4-8-16(11-14)22-18(23)13-9-10-17(20-12-13)21-15-6-2-1-3-7-15/h1-12H,(H,20,21)(H,22,23).
What are the key properties of 6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide?
6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide has a molecular weight of 368.23 g/mol, XLogP of 4.84, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109162087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).