N-(4-methyl-3-phenylphenyl)-2-oxopropanamide

C16H15NO2 — CID 110478364

IUPACN-(4-methyl-3-phenylphenyl)-2-oxopropanamide
SMILESCC(=O)C(=O)Nc1ccc(C)c(-c2ccccc2)c1
InChIInChI=1S/C16H15NO2/c1-11-8-9-14(17-16(19)12(2)18)10-15(11)13-6-4-3-5-7-13/h3-10H,1-2H3,(H,17,19)
InChIKeyYWKCDQDKMZSGGS-UHFFFAOYSA-N
MW253.30 g/mol
LogP3.19
Rot. Bonds3

About N-(4-methyl-3-phenylphenyl)-2-oxopropanamide

N-(4-methyl-3-phenylphenyl)-2-oxopropanamide (PubChem CID 110478364) has the molecular formula C16H15NO2 and a molecular weight of 253.30 g/mol. Its IUPAC name is N-(4-methyl-3-phenylphenyl)-2-oxopropanamide.

Molecular Properties

Compound NameN-(4-methyl-3-phenylphenyl)-2-oxopropanamide
PubChem CID110478364
Molecular FormulaC16H15NO2
Molecular Weight253.30 g/mol
Exact Mass253.11
IUPAC NameN-(4-methyl-3-phenylphenyl)-2-oxopropanamide
SMILESCC(=O)C(=O)Nc1ccc(C)c(-c2ccccc2)c1
InChIInChI=1S/C16H15NO2/c1-11-8-9-14(17-16(19)12(2)18)10-15(11)13-6-4-3-5-7-13/h3-10H,1-2H3,(H,17,19)
InChIKeyYWKCDQDKMZSGGS-UHFFFAOYSA-N
XLogP3.19
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[(4-methyl-3-phenylanilino)-phosphonomethyl]phosphonic acid
CID 5277498
N,N'-bis(3,4-dimethylphenyl)oxamide
CID 3278038
1-methyl-3-(4-methyl-3-pyridin-4-ylphenyl)urea
CID 143942930
2-oxo-N-(4-phenoxyphenyl)propanamide
CID 115175317
N-(3,4-diphenylphenyl)propanamide
CID 151136333
N'-(4-acetyl-3-methylphenyl)-N-phenyloxamide
CID 99702239
2-(5-acetamido-2-phenylphenyl)acetic acid
CID 11708801
N-(4-chlorophenyl)-2-oxopropanamide
CID 4252596
1-(1,3-benzodioxol-5-yl)-N-(4-methyl-3-phenylphenyl)cyclopropane-1-carboxamide
CID 59206481
2-(4-methyl-3-phenylphenyl)propanoic acid
CID 117353578
N-(2-methylphenyl)-2-oxopropanamide
CID 82125210
1-(3-isoquinolin-7-yl-4-methylphenyl)-3-phenylurea
CID 50995965

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-3-phenylphenyl)-2-oxopropanamide?
The IUPAC name of N-(4-methyl-3-phenylphenyl)-2-oxopropanamide (CID 110478364) is N-(4-methyl-3-phenylphenyl)-2-oxopropanamide.
What is the SMILES notation for N-(4-methyl-3-phenylphenyl)-2-oxopropanamide?
The canonical SMILES for N-(4-methyl-3-phenylphenyl)-2-oxopropanamide is CC(=O)C(=O)Nc1ccc(C)c(-c2ccccc2)c1.
What is the InChIKey of N-(4-methyl-3-phenylphenyl)-2-oxopropanamide?
The InChIKey is YWKCDQDKMZSGGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO2/c1-11-8-9-14(17-16(19)12(2)18)10-15(11)13-6-4-3-5-7-13/h3-10H,1-2H3,(H,17,19).
What are the key properties of N-(4-methyl-3-phenylphenyl)-2-oxopropanamide?
N-(4-methyl-3-phenylphenyl)-2-oxopropanamide has a molecular weight of 253.30 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-3-phenylphenyl)-2-oxopropanamide is sourced from PubChem (CID 110478364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).