N-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide

C12H9BrCl2N4O — CID 62244012

IUPACN-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide
SMILESNNc1ccc(C(=O)Nc2c(Cl)cc(Br)cc2Cl)cn1
InChIInChI=1S/C12H9BrCl2N4O/c13-7-3-8(14)11(9(15)4-7)18-12(20)6-1-2-10(19-16)17-5-6/h1-5H,16H2,(H,17,19)(H,18,20)
InChIKeyKDSIUDMXVAUDAL-UHFFFAOYSA-N
MW376.04 g/mol
LogP3.69
Rot. Bonds3

About N-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide

N-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide (PubChem CID 62244012) has the molecular formula C12H9BrCl2N4O and a molecular weight of 376.04 g/mol. Its IUPAC name is N-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide
PubChem CID62244012
Molecular FormulaC12H9BrCl2N4O
Molecular Weight376.04 g/mol
Exact Mass373.93
IUPAC NameN-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide
SMILESNNc1ccc(C(=O)Nc2c(Cl)cc(Br)cc2Cl)cn1
InChIInChI=1S/C12H9BrCl2N4O/c13-7-3-8(14)11(9(15)4-7)18-12(20)6-1-2-10(19-16)17-5-6/h1-5H,16H2,(H,17,19)(H,18,20)
InChIKeyKDSIUDMXVAUDAL-UHFFFAOYSA-N
XLogP3.69
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.04
LogP ≤ 53.69
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'}

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Related Compounds

N-(4-bromo-2,6-dichlorophenyl)-5-hydrazinylpyridine-2-carboxamide
CID 104642535
N-(3-bromophenyl)-6-hydrazinylpyridine-3-carboxamide
CID 62248318
N-(2,5-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide
CID 62247489
6-bromo-N-(2,4,6-trichlorophenyl)pyridine-3-carboxamide
CID 66462095
N-(4-bromo-2,6-dichlorophenyl)-4-fluorobenzamide
CID 60651944
4-(aminomethyl)-N-(4-bromo-2,6-dichlorophenyl)benzamide
CID 28993465
N-(2,6-difluoro-3-methylphenyl)-6-hydrazinylpyridine-3-carboxamide
CID 82819363
5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide
CID 107603472
6-hydrazinyl-N-(3-methylphenyl)pyridine-3-carboxamide
CID 51370235
N-(4-bromo-2,6-dichlorophenyl)-4-(bromomethyl)benzamide
CID 102850859
5-bromo-N-(2,6-dichlorophenyl)-2-hydrazinylpyridine-3-carboxamide
CID 65498887
6-hydrazinyl-N-methylpyridine-3-carboxamide;technetium-99
CID 2826732

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide?
The IUPAC name of N-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide (CID 62244012) is N-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide.
What is the SMILES notation for N-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide?
The canonical SMILES for N-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide is NNc1ccc(C(=O)Nc2c(Cl)cc(Br)cc2Cl)cn1.
What is the InChIKey of N-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide?
The InChIKey is KDSIUDMXVAUDAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrCl2N4O/c13-7-3-8(14)11(9(15)4-7)18-12(20)6-1-2-10(19-16)17-5-6/h1-5H,16H2,(H,17,19)(H,18,20).
What are the key properties of N-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide?
N-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide has a molecular weight of 376.04 g/mol, XLogP of 3.69, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide is sourced from PubChem (CID 62244012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).