N-[(4-methylphenyl)methyl]-2,2-diphenylacetamide

C22H21NO — CID 4072950

IUPACN-[(4-methylphenyl)methyl]-2,2-diphenylacetamide
SMILESCc1ccc(CNC(=O)C(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C22H21NO/c1-17-12-14-18(15-13-17)16-23-22(24)21(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-15,21H,16H2,1H3,(H,23,24)
InChIKeySLQJHIGKWQEXDQ-UHFFFAOYSA-N
MW315.42 g/mol
LogP4.44
Rot. Bonds5

About N-[(4-methylphenyl)methyl]-2,2-diphenylacetamide

N-[(4-methylphenyl)methyl]-2,2-diphenylacetamide (PubChem CID 4072950) has the molecular formula C22H21NO and a molecular weight of 315.42 g/mol. Its IUPAC name is N-[(4-methylphenyl)methyl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[(4-methylphenyl)methyl]-2,2-diphenylacetamide
PubChem CID4072950
Molecular FormulaC22H21NO
Molecular Weight315.42 g/mol
Exact Mass315.16
IUPAC NameN-[(4-methylphenyl)methyl]-2,2-diphenylacetamide
SMILESCc1ccc(CNC(=O)C(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C22H21NO/c1-17-12-14-18(15-13-17)16-23-22(24)21(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-15,21H,16H2,1H3,(H,23,24)
InChIKeySLQJHIGKWQEXDQ-UHFFFAOYSA-N
XLogP4.44
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(4-methylphenyl)methyl]-2,2-diphenylacetamide?
The IUPAC name of N-[(4-methylphenyl)methyl]-2,2-diphenylacetamide (CID 4072950) is N-[(4-methylphenyl)methyl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[(4-methylphenyl)methyl]-2,2-diphenylacetamide?
The canonical SMILES for N-[(4-methylphenyl)methyl]-2,2-diphenylacetamide is Cc1ccc(CNC(=O)C(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-[(4-methylphenyl)methyl]-2,2-diphenylacetamide?
The InChIKey is SLQJHIGKWQEXDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO/c1-17-12-14-18(15-13-17)16-23-22(24)21(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-15,21H,16H2,1H3,(H,23,24).
What are the key properties of N-[(4-methylphenyl)methyl]-2,2-diphenylacetamide?
N-[(4-methylphenyl)methyl]-2,2-diphenylacetamide has a molecular weight of 315.42 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylphenyl)methyl]-2,2-diphenylacetamide is sourced from PubChem (CID 4072950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).