2-[(2-methylphenyl)-phenylmethyl]benzamide

C21H19NO — CID 68831264

IUPAC2-[(2-methylphenyl)-phenylmethyl]benzamide
SMILESCc1ccccc1C(c1ccccc1)c1ccccc1C(N)=O
InChIInChI=1S/C21H19NO/c1-15-9-5-6-12-17(15)20(16-10-3-2-4-11-16)18-13-7-8-14-19(18)21(22)23/h2-14,20H,1H3,(H2,22,23)
InChIKeyUZGROEDGVGHBJM-UHFFFAOYSA-N
MW301.39 g/mol
LogP4.27
Rot. Bonds4

About 2-[(2-methylphenyl)-phenylmethyl]benzamide

2-[(2-methylphenyl)-phenylmethyl]benzamide (PubChem CID 68831264) has the molecular formula C21H19NO and a molecular weight of 301.39 g/mol. Its IUPAC name is 2-[(2-methylphenyl)-phenylmethyl]benzamide.

Molecular Properties

Compound Name2-[(2-methylphenyl)-phenylmethyl]benzamide
PubChem CID68831264
Molecular FormulaC21H19NO
Molecular Weight301.39 g/mol
Exact Mass301.15
IUPAC Name2-[(2-methylphenyl)-phenylmethyl]benzamide
SMILESCc1ccccc1C(c1ccccc1)c1ccccc1C(N)=O
InChIInChI=1S/C21H19NO/c1-15-9-5-6-12-17(15)20(16-10-3-2-4-11-16)18-13-7-8-14-19(18)21(22)23/h2-14,20H,1H3,(H2,22,23)
InChIKeyUZGROEDGVGHBJM-UHFFFAOYSA-N
XLogP4.27
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

2-[(2,4-dimethylphenyl)-phenylmethyl]benzamide
CID 174996851
2-[bromo(phenyl)methyl]benzamide
CID 175221886
2-[1-(8-methylnaphthalen-1-yl)ethyl]benzamide
CID 134871055
3-(2-methylphenyl)-3-oxo-2-phenylpropanamide
CID 174882127
2-methylbenzamide;molecular hydrogen
CID 177161283
[(R)-(2-methylphenyl)-phenylmethyl]urea
CID 870913
2-methylbenzamide;phenol
CID 160508327
1-(2-benzhydrylphenyl)-2-phenylethane-1,2-dione
CID 159953362
2-(1-pyridin-1-ium-1-ylethyl)benzamide
CID 66877295
2-methyl-N-[(R)-(2-methylphenyl)-phenylmethyl]benzamide
CID 28578946
2-(1-phenylethyl)benzene-1,3-dicarboxamide
CID 68956962
(2-methylphenyl)-phenylmethanamine
CID 15254157

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylphenyl)-phenylmethyl]benzamide?
The IUPAC name of 2-[(2-methylphenyl)-phenylmethyl]benzamide (CID 68831264) is 2-[(2-methylphenyl)-phenylmethyl]benzamide.
What is the SMILES notation for 2-[(2-methylphenyl)-phenylmethyl]benzamide?
The canonical SMILES for 2-[(2-methylphenyl)-phenylmethyl]benzamide is Cc1ccccc1C(c1ccccc1)c1ccccc1C(N)=O.
What is the InChIKey of 2-[(2-methylphenyl)-phenylmethyl]benzamide?
The InChIKey is UZGROEDGVGHBJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO/c1-15-9-5-6-12-17(15)20(16-10-3-2-4-11-16)18-13-7-8-14-19(18)21(22)23/h2-14,20H,1H3,(H2,22,23).
What are the key properties of 2-[(2-methylphenyl)-phenylmethyl]benzamide?
2-[(2-methylphenyl)-phenylmethyl]benzamide has a molecular weight of 301.39 g/mol, XLogP of 4.27, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylphenyl)-phenylmethyl]benzamide is sourced from PubChem (CID 68831264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).