[(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine

C16H19BrN2 — CID 105197895

IUPAC[(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine
SMILESCCCc1ccc(C(NN)c2cccc(Br)c2)cc1
InChIInChI=1S/C16H19BrN2/c1-2-4-12-7-9-13(10-8-12)16(19-18)14-5-3-6-15(17)11-14/h3,5-11,16,19H,2,4,18H2,1H3
InChIKeyRWHZTCAEAIASDM-UHFFFAOYSA-N
MW319.25 g/mol
LogP3.95
Rot. Bonds5

About [(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine

[(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine (PubChem CID 105197895) has the molecular formula C16H19BrN2 and a molecular weight of 319.25 g/mol. Its IUPAC name is [(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine
PubChem CID105197895
Molecular FormulaC16H19BrN2
Molecular Weight319.25 g/mol
Exact Mass318.07
IUPAC Name[(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine
SMILESCCCc1ccc(C(NN)c2cccc(Br)c2)cc1
InChIInChI=1S/C16H19BrN2/c1-2-4-12-7-9-13(10-8-12)16(19-18)14-5-3-6-15(17)11-14/h3,5-11,16,19H,2,4,18H2,1H3
InChIKeyRWHZTCAEAIASDM-UHFFFAOYSA-N
XLogP3.95
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.25
LogP ≤ 53.95
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 [(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine?
The IUPAC name of [(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine (CID 105197895) is [(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine.
What is the SMILES notation for [(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine?
The canonical SMILES for [(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine is CCCc1ccc(C(NN)c2cccc(Br)c2)cc1.
What is the InChIKey of [(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine?
The InChIKey is RWHZTCAEAIASDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19BrN2/c1-2-4-12-7-9-13(10-8-12)16(19-18)14-5-3-6-15(17)11-14/h3,5-11,16,19H,2,4,18H2,1H3.
What are the key properties of [(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine?
[(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine has a molecular weight of 319.25 g/mol, XLogP of 3.95, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine is sourced from PubChem (CID 105197895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).