N-phenyl-N-propanoylbenzamide

C16H15NO2 — CID 13029157

IUPACN-phenyl-N-propanoylbenzamide
SMILESCCC(=O)N(C(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H15NO2/c1-2-15(18)17(14-11-7-4-8-12-14)16(19)13-9-5-3-6-10-13/h3-12H,2H2,1H3
InChIKeyQMUVWJIAVLUDPT-UHFFFAOYSA-N
MW253.30 g/mol
LogP3.27
Rot. Bonds3

About N-phenyl-N-propanoylbenzamide

N-phenyl-N-propanoylbenzamide (PubChem CID 13029157) has the molecular formula C16H15NO2 and a molecular weight of 253.30 g/mol. Its IUPAC name is N-phenyl-N-propanoylbenzamide.

Molecular Properties

Compound NameN-phenyl-N-propanoylbenzamide
PubChem CID13029157
Molecular FormulaC16H15NO2
Molecular Weight253.30 g/mol
Exact Mass253.11
IUPAC NameN-phenyl-N-propanoylbenzamide
SMILESCCC(=O)N(C(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H15NO2/c1-2-15(18)17(14-11-7-4-8-12-14)16(19)13-9-5-3-6-10-13/h3-12H,2H2,1H3
InChIKeyQMUVWJIAVLUDPT-UHFFFAOYSA-N
XLogP3.27
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzoyl-N-[4-(dibenzoylamino)phenyl]benzamide
CID 171577154
N-(ethylcarbamothioyl)-N-phenylbenzamide
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2-[(4-acetylphenyl)-propanoylcarbamoyl]benzoic acid
CID 171978425
N-phenylpropanehydrazide
CID 18522904
N-(2-oxo-2-phenylacetyl)-N-phenylbenzamide
CID 11782445
1-phenyl(111C)propan-1-one
CID 11159350
N,N-dimethylmethanamine;1-phenylpropan-1-one
CID 174454319
benzoyl(methyl)carbamic acid;hydrochloride
CID 70634624
methane;1-phenylpropan-1-one
CID 67638055
1-phenylpropan-1-one;zirconium
CID 173295106
2-[benzoyl(propanoyl)amino]-3-hydroxypropanoic acid
CID 70817401
CID 174412487
CID 174412487

Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-propanoylbenzamide?
The IUPAC name of N-phenyl-N-propanoylbenzamide (CID 13029157) is N-phenyl-N-propanoylbenzamide.
What is the SMILES notation for N-phenyl-N-propanoylbenzamide?
The canonical SMILES for N-phenyl-N-propanoylbenzamide is CCC(=O)N(C(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of N-phenyl-N-propanoylbenzamide?
The InChIKey is QMUVWJIAVLUDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO2/c1-2-15(18)17(14-11-7-4-8-12-14)16(19)13-9-5-3-6-10-13/h3-12H,2H2,1H3.
What are the key properties of N-phenyl-N-propanoylbenzamide?
N-phenyl-N-propanoylbenzamide has a molecular weight of 253.30 g/mol, XLogP of 3.27, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N-propanoylbenzamide is sourced from PubChem (CID 13029157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).