N-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide

C12H11BrN4O — CID 62248318

IUPACN-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide
SMILESNNc1ccc(C(=O)Nc2cccc(Br)c2)cn1
InChIInChI=1S/C12H11BrN4O/c13-9-2-1-3-10(6-9)16-12(18)8-4-5-11(17-14)15-7-8/h1-7H,14H2,(H,15,17)(H,16,18)
InChIKeyCLWJGOOVVAXYGU-UHFFFAOYSA-N
MW307.15 g/mol
LogP2.38
Rot. Bonds3

About N-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide

N-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide (PubChem CID 62248318) has the molecular formula C12H11BrN4O and a molecular weight of 307.15 g/mol. Its IUPAC name is N-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide
PubChem CID62248318
Molecular FormulaC12H11BrN4O
Molecular Weight307.15 g/mol
Exact Mass306.01
IUPAC NameN-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide
SMILESNNc1ccc(C(=O)Nc2cccc(Br)c2)cn1
InChIInChI=1S/C12H11BrN4O/c13-9-2-1-3-10(6-9)16-12(18)8-4-5-11(17-14)15-7-8/h1-7H,14H2,(H,15,17)(H,16,18)
InChIKeyCLWJGOOVVAXYGU-UHFFFAOYSA-N
XLogP2.38
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.15
LogP ≤ 52.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(3-bromophenyl)-6-hydrazinylpyridine-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

6-hydrazinyl-N-(3-methylphenyl)pyridine-3-carboxamide
CID 51370235
6-anilino-N-(3-bromophenyl)pyridine-3-carboxamide
CID 109162087
N-(3-bromophenyl)-6-(cyclopentylamino)pyridine-3-carboxamide
CID 109152213
N-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide
CID 62247489
6-(3-bromoanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109163992
N-(4-bromo-3-nitrophenyl)-6-hydrazinylpyridine-3-carboxamide
CID 79760195
N-(3-bromophenyl)-6-[3-(dimethylamino)propylamino]pyridine-3-carboxamide
CID 109154345
4-N-(3-bromophenyl)benzene-1,4-dicarboxamide
CID 30844565
N-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide
CID 62244012
6-amino-N-(3-bromophenyl)-5-chloropyridine-3-carboxamide
CID 62154024
N-(3-bromophenyl)-5,6-dichloropyridine-3-carboxamide
CID 2095074
N-(3-bromophenyl)-4-carbamothioylbenzamide
CID 24708303

Frequently Asked Questions

What is the IUPAC name of N-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide?
The IUPAC name of N-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide (CID 62248318) is N-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide.
What is the SMILES notation for N-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide?
The canonical SMILES for N-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide is NNc1ccc(C(=O)Nc2cccc(Br)c2)cn1.
What is the InChIKey of N-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide?
The InChIKey is CLWJGOOVVAXYGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrN4O/c13-9-2-1-3-10(6-9)16-12(18)8-4-5-11(17-14)15-7-8/h1-7H,14H2,(H,15,17)(H,16,18).
What are the key properties of N-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide?
N-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide has a molecular weight of 307.15 g/mol, XLogP of 2.38, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide is sourced from PubChem (CID 62248318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).