[(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine

C15H17BrN2 — CID 105192528

IUPAC[(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine
SMILESCc1cc(C)cc(C(NN)c2ccc(Br)cc2)c1
InChIInChI=1S/C15H17BrN2/c1-10-7-11(2)9-13(8-10)15(18-17)12-3-5-14(16)6-4-12/h3-9,15,18H,17H2,1-2H3
InChIKeyIDJBLHGTAGIAFV-UHFFFAOYSA-N
MW305.22 g/mol
LogP3.62
Rot. Bonds3

About [(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine

[(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine (PubChem CID 105192528) has the molecular formula C15H17BrN2 and a molecular weight of 305.22 g/mol. Its IUPAC name is [(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine
PubChem CID105192528
Molecular FormulaC15H17BrN2
Molecular Weight305.22 g/mol
Exact Mass304.06
IUPAC Name[(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine
SMILESCc1cc(C)cc(C(NN)c2ccc(Br)cc2)c1
InChIInChI=1S/C15H17BrN2/c1-10-7-11(2)9-13(8-10)15(18-17)12-3-5-14(16)6-4-12/h3-9,15,18H,17H2,1-2H3
InChIKeyIDJBLHGTAGIAFV-UHFFFAOYSA-N
XLogP3.62
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.22
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine?
The IUPAC name of [(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine (CID 105192528) is [(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine.
What is the SMILES notation for [(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine?
The canonical SMILES for [(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine is Cc1cc(C)cc(C(NN)c2ccc(Br)cc2)c1.
What is the InChIKey of [(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine?
The InChIKey is IDJBLHGTAGIAFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN2/c1-10-7-11(2)9-13(8-10)15(18-17)12-3-5-14(16)6-4-12/h3-9,15,18H,17H2,1-2H3.
What are the key properties of [(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine?
[(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine has a molecular weight of 305.22 g/mol, XLogP of 3.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine is sourced from PubChem (CID 105192528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).