1-[(4-chlorophenyl)methyl]-2-phenylhydrazine

C13H13ClN2 — CID 70410939

IUPAC1-[(4-chlorophenyl)methyl]-2-phenylhydrazine
SMILESClc1ccc(CNNc2ccccc2)cc1
InChIInChI=1S/C13H13ClN2/c14-12-8-6-11(7-9-12)10-15-16-13-4-2-1-3-5-13/h1-9,15-16H,10H2
InChIKeyYCHMPFGKJINAFF-UHFFFAOYSA-N
MW232.71 g/mol
LogP3.46
Rot. Bonds4

About 1-[(4-chlorophenyl)methyl]-2-phenylhydrazine

1-[(4-chlorophenyl)methyl]-2-phenylhydrazine (PubChem CID 70410939) has the molecular formula C13H13ClN2 and a molecular weight of 232.71 g/mol. Its IUPAC name is 1-[(4-chlorophenyl)methyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[(4-chlorophenyl)methyl]-2-phenylhydrazine
PubChem CID70410939
Molecular FormulaC13H13ClN2
Molecular Weight232.71 g/mol
Exact Mass232.08
IUPAC Name1-[(4-chlorophenyl)methyl]-2-phenylhydrazine
SMILESClc1ccc(CNNc2ccccc2)cc1
InChIInChI=1S/C13H13ClN2/c14-12-8-6-11(7-9-12)10-15-16-13-4-2-1-3-5-13/h1-9,15-16H,10H2
InChIKeyYCHMPFGKJINAFF-UHFFFAOYSA-N
XLogP3.46
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.71
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-chlorophenyl)methyl]-2-phenylhydrazine?
The IUPAC name of 1-[(4-chlorophenyl)methyl]-2-phenylhydrazine (CID 70410939) is 1-[(4-chlorophenyl)methyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[(4-chlorophenyl)methyl]-2-phenylhydrazine?
The canonical SMILES for 1-[(4-chlorophenyl)methyl]-2-phenylhydrazine is Clc1ccc(CNNc2ccccc2)cc1.
What is the InChIKey of 1-[(4-chlorophenyl)methyl]-2-phenylhydrazine?
The InChIKey is YCHMPFGKJINAFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN2/c14-12-8-6-11(7-9-12)10-15-16-13-4-2-1-3-5-13/h1-9,15-16H,10H2.
What are the key properties of 1-[(4-chlorophenyl)methyl]-2-phenylhydrazine?
1-[(4-chlorophenyl)methyl]-2-phenylhydrazine has a molecular weight of 232.71 g/mol, XLogP of 3.46, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-chlorophenyl)methyl]-2-phenylhydrazine is sourced from PubChem (CID 70410939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).