N'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide

C20H23ClN2O — CID 118569511

IUPACN'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide
SMILESON/C(CC1CCC(c2ccccc2)CC1)=N\c1ccc(Cl)cc1
InChIInChI=1S/C20H23ClN2O/c21-18-10-12-19(13-11-18)22-20(23-24)14-15-6-8-17(9-7-15)16-4-2-1-3-5-16/h1-5,10-13,15,17,24H,6-9,14H2,(H,22,23)
InChIKeyTWMPAKNCZNAWJV-UHFFFAOYSA-N
MW342.87 g/mol
LogP5.71
Rot. Bonds4

About N'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide

N'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide (PubChem CID 118569511) has the molecular formula C20H23ClN2O and a molecular weight of 342.87 g/mol. Its IUPAC name is N'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide.

Molecular Properties

Compound NameN'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide
PubChem CID118569511
Molecular FormulaC20H23ClN2O
Molecular Weight342.87 g/mol
Exact Mass342.15
IUPAC NameN'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide
SMILESON/C(CC1CCC(c2ccccc2)CC1)=N\c1ccc(Cl)cc1
InChIInChI=1S/C20H23ClN2O/c21-18-10-12-19(13-11-18)22-20(23-24)14-15-6-8-17(9-7-15)16-4-2-1-3-5-16/h1-5,10-13,15,17,24H,6-9,14H2,(H,22,23)
InChIKeyTWMPAKNCZNAWJV-UHFFFAOYSA-N
XLogP5.71
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.87
LogP ≤ 55.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide?
The IUPAC name of N'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide (CID 118569511) is N'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide.
What is the SMILES notation for N'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide?
The canonical SMILES for N'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide is ON/C(CC1CCC(c2ccccc2)CC1)=N\c1ccc(Cl)cc1.
What is the InChIKey of N'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide?
The InChIKey is TWMPAKNCZNAWJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN2O/c21-18-10-12-19(13-11-18)22-20(23-24)14-15-6-8-17(9-7-15)16-4-2-1-3-5-16/h1-5,10-13,15,17,24H,6-9,14H2,(H,22,23).
What are the key properties of N'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide?
N'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide has a molecular weight of 342.87 g/mol, XLogP of 5.71, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-chlorophenyl)-N-hydroxy-2-(4-phenylcyclohexyl)ethanimidamide is sourced from PubChem (CID 118569511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).