2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide

C20H18N2 — CID 152558891

IUPAC2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide
SMILESCc1ccc(-c2ccccc2/C(N)=N/c2ccccc2)cc1
InChIInChI=1S/C20H18N2/c1-15-11-13-16(14-12-15)18-9-5-6-10-19(18)20(21)22-17-7-3-2-4-8-17/h2-14H,1H3,(H2,21,22)
InChIKeyYPBLFZPIQLYNTL-UHFFFAOYSA-N
MW286.38 g/mol
LogP4.70
Rot. Bonds3

About 2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide

2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide (PubChem CID 152558891) has the molecular formula C20H18N2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide.

Molecular Properties

Compound Name2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide
PubChem CID152558891
Molecular FormulaC20H18N2
Molecular Weight286.38 g/mol
Exact Mass286.15
IUPAC Name2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide
SMILESCc1ccc(-c2ccccc2/C(N)=N/c2ccccc2)cc1
InChIInChI=1S/C20H18N2/c1-15-11-13-16(14-12-15)18-9-5-6-10-19(18)20(21)22-17-7-3-2-4-8-17/h2-14H,1H3,(H2,21,22)
InChIKeyYPBLFZPIQLYNTL-UHFFFAOYSA-N
XLogP4.70
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 54.70
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 2-(4-methylphenyl)-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

Related Compounds

N'-methyl-2-(4-methylsulfanylphenyl)benzenecarboximidamide
CID 18771509
N'-amino-2-[4-(hydroxymethyl)phenyl]benzenecarboximidamide
CID 54093932
N,N'-diamino-2-(4-methylphenyl)benzenecarboximidamide
CID 137403371
2-[4-[[amino-(diaminomethylideneamino)methylidene]amino]phenyl]benzoic acid
CID 168604342
2-[2-(4-fluorophenyl)ethenyl]-N'-phenylbenzenecarboximidamide
CID 175026148
2-phenyl-N'-(trifluoromethyl)benzenecarboximidamide
CID 118916827
ethyl 2-(4-methylphenyl)benzoate
CID 10922668
N'-[(Z)-[amino-(2-fluorophenyl)methylidene]amino]-2-phenylbenzenecarboximidamide
CID 129205464
1-N',4-N'-diphenylbenzene-1,4-dicarboximidamide;dihydrochloride
CID 131872163
2-amino-4,5-dimethoxy-N'-phenylbenzenecarboximidamide
CID 86278868
1-[2-(4-methylphenyl)phenyl]propan-1-one
CID 67873243
(2-methylphenyl)-[2-(4-methylphenyl)phenyl]methanone
CID 171716642

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide?
The IUPAC name of 2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide (CID 152558891) is 2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide.
What is the SMILES notation for 2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide?
The canonical SMILES for 2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide is Cc1ccc(-c2ccccc2/C(N)=N/c2ccccc2)cc1.
What is the InChIKey of 2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide?
The InChIKey is YPBLFZPIQLYNTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2/c1-15-11-13-16(14-12-15)18-9-5-6-10-19(18)20(21)22-17-7-3-2-4-8-17/h2-14H,1H3,(H2,21,22).
What are the key properties of 2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide?
2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide has a molecular weight of 286.38 g/mol, XLogP of 4.70, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-N'-phenylbenzenecarboximidamide is sourced from PubChem (CID 152558891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).