N-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide

C18H20BrN3O — CID 109226928

IUPACN-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Br)cc1)c1cncc(NC2CCCCC2)c1
InChIInChI=1S/C18H20BrN3O/c19-14-6-8-16(9-7-14)22-18(23)13-10-17(12-20-11-13)21-15-4-2-1-3-5-15/h6-12,15,21H,1-5H2,(H,22,23)
InChIKeyGUWGVLXQQXAFGW-UHFFFAOYSA-N
MW374.28 g/mol
LogP4.84
Rot. Bonds4

About N-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide

N-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide (PubChem CID 109226928) has the molecular formula C18H20BrN3O and a molecular weight of 374.28 g/mol. Its IUPAC name is N-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
PubChem CID109226928
Molecular FormulaC18H20BrN3O
Molecular Weight374.28 g/mol
Exact Mass373.08
IUPAC NameN-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Br)cc1)c1cncc(NC2CCCCC2)c1
InChIInChI=1S/C18H20BrN3O/c19-14-6-8-16(9-7-14)22-18(23)13-10-17(12-20-11-13)21-15-4-2-1-3-5-15/h6-12,15,21H,1-5H2,(H,22,23)
InChIKeyGUWGVLXQQXAFGW-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 ≤ 500374.28
LogP ≤ 54.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4-bromophenyl)-5-(cyclohexylamino)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

N-(4-bromophenyl)-5-(cyclopropylamino)pyridine-3-carboxamide
CID 109223876
N-(3-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226964
methyl 4-[[5-(cyclohexylamino)pyridine-3-carbonyl]amino]benzoate
CID 109226950
N-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226990
5-(cyclopentylamino)-N-[4-(dimethylamino)phenyl]pyridine-3-carboxamide
CID 109226211
N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226946
N-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226944
5-(cyclopentylamino)-N-(3,5-dichlorophenyl)pyridine-3-carboxamide
CID 109226240
N-(3-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226989
N-(4-bromophenyl)-2-(cyclohexylamino)pyridine-4-carboxamide
CID 109166358
5-(cyclopentylamino)-N-cyclopropylpyridine-3-carboxamide
CID 109223558
5-(cycloheptylamino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109239626

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
The IUPAC name of N-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide (CID 109226928) is N-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide is O=C(Nc1ccc(Br)cc1)c1cncc(NC2CCCCC2)c1.
What is the InChIKey of N-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
The InChIKey is GUWGVLXQQXAFGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20BrN3O/c19-14-6-8-16(9-7-14)22-18(23)13-10-17(12-20-11-13)21-15-4-2-1-3-5-15/h6-12,15,21H,1-5H2,(H,22,23).
What are the key properties of N-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
N-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide has a molecular weight of 374.28 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 N-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109226928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).