N-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide

C13H15NO2 — CID 134269746

IUPACN-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide
SMILESCC(=O)C(NC(=O)C1CC1)c1ccccc1
InChIInChI=1S/C13H15NO2/c1-9(15)12(10-5-3-2-4-6-10)14-13(16)11-7-8-11/h2-6,11-12H,7-8H2,1H3,(H,14,16)
InChIKeyQAKBWDGSUFCLMU-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.84
Rot. Bonds4

About N-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide

N-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide (PubChem CID 134269746) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is N-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide
PubChem CID134269746
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC NameN-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide
SMILESCC(=O)C(NC(=O)C1CC1)c1ccccc1
InChIInChI=1S/C13H15NO2/c1-9(15)12(10-5-3-2-4-6-10)14-13(16)11-7-8-11/h2-6,11-12H,7-8H2,1H3,(H,14,16)
InChIKeyQAKBWDGSUFCLMU-UHFFFAOYSA-N
XLogP1.84
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,4-N-bis[(1S)-1-phenylethyl]cyclohexane-1,4-dicarboxamide
CID 40636599
(2R)-2-(cyclooctanecarbonylamino)-2-phenylacetic acid
CID 65018923
N-[(1S)-2-(4-methylpiperazin-1-yl)-2-oxo-1-phenylethyl]cyclopropanecarboxamide
CID 110286992
(2S)-2-(oxane-4-carbonylamino)-2-phenylacetic acid
CID 28778740
(2R)-2-[[4-(cyclopentanecarbonylamino)cyclohexanecarbonyl]amino]-2-phenylacetic acid
CID 119368013
N-(2-bromo-1-phenylethyl)cyclopropanecarboxamide
CID 114311037
N-(1-phenylethyl)piperidine-4-carboxamide
CID 2903820
N-[(1R)-1-[3-[(4R)-2-methyl-4-[[2-(oxan-4-yl)acetyl]amino]-3-oxo-4-phenylbutyl]phenyl]-2-oxopropyl]cyclopropanecarboxamide
CID 146518938
(1S)-1-(methylamino)-1-phenylpropan-2-one
CID 59960222
N-benzhydrylpiperidine-4-carboxamide
CID 119263888
(2S)-2-phenyl-2-[[1-(pyrrolidine-1-carbonyl)piperidine-4-carbonyl]amino]acetic acid
CID 119372610
(2R)-2-phenyl-2-[(1-sulfamoylpiperidine-4-carbonyl)amino]acetic acid
CID 119367985

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide?
The IUPAC name of N-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide (CID 134269746) is N-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide.
What is the SMILES notation for N-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide?
The canonical SMILES for N-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide is CC(=O)C(NC(=O)C1CC1)c1ccccc1.
What is the InChIKey of N-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide?
The InChIKey is QAKBWDGSUFCLMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2/c1-9(15)12(10-5-3-2-4-6-10)14-13(16)11-7-8-11/h2-6,11-12H,7-8H2,1H3,(H,14,16).
What are the key properties of N-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide?
N-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide has a molecular weight of 217.27 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-1-phenylpropyl)cyclopropanecarboxamide is sourced from PubChem (CID 134269746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).