1-(3-chlorocinnolin-4-yl)-2-phenylhydrazine

C14H11ClN4 — CID 86018668

IUPAC1-(3-chlorocinnolin-4-yl)-2-phenylhydrazine
SMILESClc1nnc2ccccc2c1NNc1ccccc1
InChIInChI=1S/C14H11ClN4/c15-14-13(18-16-10-6-2-1-3-7-10)11-8-4-5-9-12(11)17-19-14/h1-9,16H,(H,17,18)
InChIKeyIYEWSROKAFDSHE-UHFFFAOYSA-N
MW270.72 g/mol
LogP3.72
Rot. Bonds3

About 1-(3-chlorocinnolin-4-yl)-2-phenylhydrazine

1-(3-chlorocinnolin-4-yl)-2-phenylhydrazine (PubChem CID 86018668) has the molecular formula C14H11ClN4 and a molecular weight of 270.72 g/mol. Its IUPAC name is 1-(3-chlorocinnolin-4-yl)-2-phenylhydrazine.

Molecular Properties

Compound Name1-(3-chlorocinnolin-4-yl)-2-phenylhydrazine
PubChem CID86018668
Molecular FormulaC14H11ClN4
Molecular Weight270.72 g/mol
Exact Mass270.07
IUPAC Name1-(3-chlorocinnolin-4-yl)-2-phenylhydrazine
SMILESClc1nnc2ccccc2c1NNc1ccccc1
InChIInChI=1S/C14H11ClN4/c15-14-13(18-16-10-6-2-1-3-7-10)11-8-4-5-9-12(11)17-19-14/h1-9,16H,(H,17,18)
InChIKeyIYEWSROKAFDSHE-UHFFFAOYSA-N
XLogP3.72
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(3-chlorocinnolin-4-yl)-2-phenylhydrazine?
The IUPAC name of 1-(3-chlorocinnolin-4-yl)-2-phenylhydrazine (CID 86018668) is 1-(3-chlorocinnolin-4-yl)-2-phenylhydrazine.
What is the SMILES notation for 1-(3-chlorocinnolin-4-yl)-2-phenylhydrazine?
The canonical SMILES for 1-(3-chlorocinnolin-4-yl)-2-phenylhydrazine is Clc1nnc2ccccc2c1NNc1ccccc1.
What is the InChIKey of 1-(3-chlorocinnolin-4-yl)-2-phenylhydrazine?
The InChIKey is IYEWSROKAFDSHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN4/c15-14-13(18-16-10-6-2-1-3-7-10)11-8-4-5-9-12(11)17-19-14/h1-9,16H,(H,17,18).
What are the key properties of 1-(3-chlorocinnolin-4-yl)-2-phenylhydrazine?
1-(3-chlorocinnolin-4-yl)-2-phenylhydrazine has a molecular weight of 270.72 g/mol, XLogP of 3.72, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorocinnolin-4-yl)-2-phenylhydrazine is sourced from PubChem (CID 86018668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).