N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide

C13H12BrClN4O — CID 81272267

IUPACN-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
SMILESCc1cc(NN)c(C(=O)Nc2cc(Cl)ccc2Br)cn1
InChIInChI=1S/C13H12BrClN4O/c1-7-4-11(19-16)9(6-17-7)13(20)18-12-5-8(15)2-3-10(12)14/h2-6H,16H2,1H3,(H,17,19)(H,18,20)
InChIKeyWCZRXZHCBQYLBI-UHFFFAOYSA-N
MW355.62 g/mol
LogP3.34
Rot. Bonds3

About N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide

N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide (PubChem CID 81272267) has the molecular formula C13H12BrClN4O and a molecular weight of 355.62 g/mol. Its IUPAC name is N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
PubChem CID81272267
Molecular FormulaC13H12BrClN4O
Molecular Weight355.62 g/mol
Exact Mass353.99
IUPAC NameN-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
SMILESCc1cc(NN)c(C(=O)Nc2cc(Cl)ccc2Br)cn1
InChIInChI=1S/C13H12BrClN4O/c1-7-4-11(19-16)9(6-17-7)13(20)18-12-5-8(15)2-3-10(12)14/h2-6H,16H2,1H3,(H,17,19)(H,18,20)
InChIKeyWCZRXZHCBQYLBI-UHFFFAOYSA-N
XLogP3.34
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.62
LogP ≤ 53.34
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-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 107603475
N-(3,5-dichlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81256534
N-(2-bromo-5-chlorophenyl)-6-methylpyridine-3-carboxamide
CID 81272102
N-(5-chloro-2-methylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81233865
N-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81256857
5-chloro-N-(2,5-dibromophenyl)-2-hydrazinylbenzamide
CID 62247491
N-(5-bromo-2-methoxyphenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81245507
4-amino-N-(5-chloro-2-methylphenyl)-6-methylpyridine-3-carboxamide
CID 81233570
4-hydrazinyl-6-methyl-N-pyridin-2-ylpyridine-3-carboxamide
CID 81256191
2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide
CID 81270262
N-(5-chloro-2-methoxyphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81237297
N-(5-bromo-4-methyl-2-pyridinyl)-5-chloro-2-hydrazinylbenzamide
CID 79729244

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide?
The IUPAC name of N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide (CID 81272267) is N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide is Cc1cc(NN)c(C(=O)Nc2cc(Cl)ccc2Br)cn1.
What is the InChIKey of N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide?
The InChIKey is WCZRXZHCBQYLBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12BrClN4O/c1-7-4-11(19-16)9(6-17-7)13(20)18-12-5-8(15)2-3-10(12)14/h2-6H,16H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide?
N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide has a molecular weight of 355.62 g/mol, XLogP of 3.34, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 81272267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).