N'-(benzyliminomethyl)benzenecarboximidamide

C15H15N3 — CID 118508894

IUPACN'-(benzyliminomethyl)benzenecarboximidamide
SMILESN/C(=N\C=N\Cc1ccccc1)c1ccccc1
InChIInChI=1S/C15H15N3/c16-15(14-9-5-2-6-10-14)18-12-17-11-13-7-3-1-4-8-13/h1-10,12H,11H2,(H2,16,17,18)
InChIKeyZXAGYBKKPXDUCT-UHFFFAOYSA-N
MW237.31 g/mol
LogP2.62
Rot. Bonds4

About N'-(benzyliminomethyl)benzenecarboximidamide

N'-(benzyliminomethyl)benzenecarboximidamide (PubChem CID 118508894) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is N'-(benzyliminomethyl)benzenecarboximidamide.

Molecular Properties

Compound NameN'-(benzyliminomethyl)benzenecarboximidamide
PubChem CID118508894
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC NameN'-(benzyliminomethyl)benzenecarboximidamide
SMILESN/C(=N\C=N\Cc1ccccc1)c1ccccc1
InChIInChI=1S/C15H15N3/c16-15(14-9-5-2-6-10-14)18-12-17-11-13-7-3-1-4-8-13/h1-10,12H,11H2,(H2,16,17,18)
InChIKeyZXAGYBKKPXDUCT-UHFFFAOYSA-N
XLogP2.62
TPSA50.74 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 52.62
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'-(benzyliminomethyl)benzenecarboximidamide with MolForge

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

Launch Full Analysis

Related Compounds

3-benzylimino-1-(3-bromophenyl)prop-1-en-1-amine
CID 174087166
(Z)-N-benzylbut-2-en-1-imine
CID 141334721
N'-[(Z)-prop-1-enyl]benzenecarboximidamide
CID 137386486
N-benzyl-3-methylsulfanyl-3-phenylprop-2-en-1-imine
CID 71409068
benzyliminotungsten
CID 21354480
N'-hydroxybenzenecarboximidamide
CID 142861747
N'-aminobenzenecarboximidamide
CID 5474957
N'-benzyl-3-phenylbenzenecarboximidamide
CID 142527130
5-[3-(1-amino-3-benzyliminoprop-1-enyl)phenyl]pyridine-3-carboxamide
CID 174087173
N'-hydroxybenzenecarboximidamide;pentahydrate
CID 174367022
N'-benzyl-2,1,3-benzothiadiazole-5-carboximidamide
CID 20706472
N'-trimethylsilyloxybenzenecarboximidamide
CID 71365359

Frequently Asked Questions

What is the IUPAC name of N'-(benzyliminomethyl)benzenecarboximidamide?
The IUPAC name of N'-(benzyliminomethyl)benzenecarboximidamide (CID 118508894) is N'-(benzyliminomethyl)benzenecarboximidamide.
What is the SMILES notation for N'-(benzyliminomethyl)benzenecarboximidamide?
The canonical SMILES for N'-(benzyliminomethyl)benzenecarboximidamide is N/C(=N\C=N\Cc1ccccc1)c1ccccc1.
What is the InChIKey of N'-(benzyliminomethyl)benzenecarboximidamide?
The InChIKey is ZXAGYBKKPXDUCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c16-15(14-9-5-2-6-10-14)18-12-17-11-13-7-3-1-4-8-13/h1-10,12H,11H2,(H2,16,17,18).
What are the key properties of N'-(benzyliminomethyl)benzenecarboximidamide?
N'-(benzyliminomethyl)benzenecarboximidamide has a molecular weight of 237.31 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(benzyliminomethyl)benzenecarboximidamide is sourced from PubChem (CID 118508894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).