N'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide

C19H15ClN2 — CID 602108

IUPACN'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide
SMILESClc1ccc(/N=C(\Nc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C19H15ClN2/c20-16-11-13-18(14-12-16)22-19(15-7-3-1-4-8-15)21-17-9-5-2-6-10-17/h1-14H,(H,21,22)
InChIKeyIRZHWMCDQVPFHO-UHFFFAOYSA-N
MW306.80 g/mol
LogP5.53
Rot. Bonds3

About N'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide

N'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide (PubChem CID 602108) has the molecular formula C19H15ClN2 and a molecular weight of 306.80 g/mol. Its IUPAC name is N'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide.

Molecular Properties

Compound NameN'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide
PubChem CID602108
Molecular FormulaC19H15ClN2
Molecular Weight306.80 g/mol
Exact Mass306.09
IUPAC NameN'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide
SMILESClc1ccc(/N=C(\Nc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C19H15ClN2/c20-16-11-13-18(14-12-16)22-19(15-7-3-1-4-8-15)21-17-9-5-2-6-10-17/h1-14H,(H,21,22)
InChIKeyIRZHWMCDQVPFHO-UHFFFAOYSA-N
XLogP5.53
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.80
LogP ≤ 55.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide 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-phenylbenzenecarboximidamide?
The IUPAC name of N'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide (CID 602108) is N'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide.
What is the SMILES notation for N'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide?
The canonical SMILES for N'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide is Clc1ccc(/N=C(\Nc2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide?
The InChIKey is IRZHWMCDQVPFHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN2/c20-16-11-13-18(14-12-16)22-19(15-7-3-1-4-8-15)21-17-9-5-2-6-10-17/h1-14H,(H,21,22).
What are the key properties of N'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide?
N'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide has a molecular weight of 306.80 g/mol, XLogP of 5.53, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-chlorophenyl)-N-phenylbenzenecarboximidamide is sourced from PubChem (CID 602108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).