[(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine

C12H11BrClN3 — CID 105261077

IUPAC[(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine
SMILESNNC(c1cccnc1)c1ccc(Cl)c(Br)c1
InChIInChI=1S/C12H11BrClN3/c13-10-6-8(3-4-11(10)14)12(17-15)9-2-1-5-16-7-9/h1-7,12,17H,15H2
InChIKeyVHEFIHRHAZUUCB-UHFFFAOYSA-N
MW312.60 g/mol
LogP3.05
Rot. Bonds3

About [(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine

[(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine (PubChem CID 105261077) has the molecular formula C12H11BrClN3 and a molecular weight of 312.60 g/mol. Its IUPAC name is [(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine
PubChem CID105261077
Molecular FormulaC12H11BrClN3
Molecular Weight312.60 g/mol
Exact Mass310.98
IUPAC Name[(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine
SMILESNNC(c1cccnc1)c1ccc(Cl)c(Br)c1
InChIInChI=1S/C12H11BrClN3/c13-10-6-8(3-4-11(10)14)12(17-15)9-2-1-5-16-7-9/h1-7,12,17H,15H2
InChIKeyVHEFIHRHAZUUCB-UHFFFAOYSA-N
XLogP3.05
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.60
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

[(3-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine
CID 105261003
[(3,4-difluorophenyl)-pyridin-3-ylmethyl]hydrazine
CID 105196161
[(3-bromo-4-chlorophenyl)-(4-tert-butylphenyl)methyl]hydrazine
CID 105261121
[(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine
CID 105261045
[(3-bromo-4-chlorophenyl)-(4-methoxyphenyl)methyl]hydrazine
CID 105260984
[(2-chloro-4-methylphenyl)-pyridin-3-ylmethyl]hydrazine
CID 106859713
[(3-bromothiophen-2-yl)-pyridin-3-ylmethyl]hydrazine
CID 105196295
[(3-bromo-4-chlorophenyl)-(2-fluorophenyl)methyl]hydrazine
CID 105260937
[[3-fluoro-4-(trifluoromethyl)phenyl]-pyridin-3-ylmethyl]hydrazine
CID 107292241
[(3-chloro-4,5-dimethoxyphenyl)-pyridin-3-ylmethyl]hydrazine
CID 105204624
[(3-bromo-4-chlorophenyl)-(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine
CID 105261083
[(3-bromo-4-chlorophenyl)-(5-bromo-3-methyltriazol-4-yl)methyl]hydrazine
CID 106466170

Frequently Asked Questions

What is the IUPAC name of [(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine?
The IUPAC name of [(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine (CID 105261077) is [(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine.
What is the SMILES notation for [(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine?
The canonical SMILES for [(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine is NNC(c1cccnc1)c1ccc(Cl)c(Br)c1.
What is the InChIKey of [(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine?
The InChIKey is VHEFIHRHAZUUCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrClN3/c13-10-6-8(3-4-11(10)14)12(17-15)9-2-1-5-16-7-9/h1-7,12,17H,15H2.
What are the key properties of [(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine?
[(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine has a molecular weight of 312.60 g/mol, XLogP of 3.05, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-4-chlorophenyl)-pyridin-3-ylmethyl]hydrazine is sourced from PubChem (CID 105261077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).