N-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide

C24H23NO — CID 141050503

IUPACN-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide
SMILESC=C(C)Cc1ccc(-c2ccccc2)c(CNC(=O)c2ccccc2)c1
InChIInChI=1S/C24H23NO/c1-18(2)15-19-13-14-23(20-9-5-3-6-10-20)22(16-19)17-25-24(26)21-11-7-4-8-12-21/h3-14,16H,1,15,17H2,2H3,(H,25,26)
InChIKeyMWCWFQZSQLCELC-UHFFFAOYSA-N
MW341.45 g/mol
LogP5.40
Rot. Bonds6

About N-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide

N-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide (PubChem CID 141050503) has the molecular formula C24H23NO and a molecular weight of 341.45 g/mol. Its IUPAC name is N-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide.

Molecular Properties

Compound NameN-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide
PubChem CID141050503
Molecular FormulaC24H23NO
Molecular Weight341.45 g/mol
Exact Mass341.18
IUPAC NameN-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide
SMILESC=C(C)Cc1ccc(-c2ccccc2)c(CNC(=O)c2ccccc2)c1
InChIInChI=1S/C24H23NO/c1-18(2)15-19-13-14-23(20-9-5-3-6-10-20)22(16-19)17-25-24(26)21-11-7-4-8-12-21/h3-14,16H,1,15,17H2,2H3,(H,25,26)
InChIKeyMWCWFQZSQLCELC-UHFFFAOYSA-N
XLogP5.40
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.45
LogP ≤ 55.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-4-(2-methylprop-2-enyl)-1-phenylbenzene
CID 146002696
N-[[5-(benzamidomethyl)-2,4-dimethylphenyl]methyl]benzamide
CID 154149793
N-[[2-(4-bromophenyl)phenyl]methyl]benzamide
CID 134869465
N-[(2-phenylphenyl)methyl]pyridine-4-carboxamide
CID 23497805
2-[4-(benzamidomethyl)phenyl]acetic acid
CID 89464611
4-acetyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide
CID 111115313
N-[(4-methylphenyl)methyl]-4-phenylbenzamide
CID 1228171
N-[(2,3-dihydroxyphenyl)methyl]benzamide
CID 143948328
N-[[4-(2-hydroxyethyl)phenyl]methyl]benzamide
CID 67712441
4-(benzamidomethyl)benzoic acid
CID 10879683
N-(naphthalen-2-ylmethyl)benzamide
CID 47161333
[2-(benzamidomethyl)phenyl]boronic acid
CID 10244067

Frequently Asked Questions

What is the IUPAC name of N-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide?
The IUPAC name of N-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide (CID 141050503) is N-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide.
What is the SMILES notation for N-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide?
The canonical SMILES for N-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide is C=C(C)Cc1ccc(-c2ccccc2)c(CNC(=O)c2ccccc2)c1.
What is the InChIKey of N-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide?
The InChIKey is MWCWFQZSQLCELC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO/c1-18(2)15-19-13-14-23(20-9-5-3-6-10-20)22(16-19)17-25-24(26)21-11-7-4-8-12-21/h3-14,16H,1,15,17H2,2H3,(H,25,26).
What are the key properties of N-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide?
N-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide has a molecular weight of 341.45 g/mol, XLogP of 5.40, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(2-methylprop-2-enyl)-2-phenylphenyl]methyl]benzamide is sourced from PubChem (CID 141050503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).