1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one

C16H20N2O2 — CID 119034196

IUPAC1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one
SMILESCC(C(=O)N1CCN(C2CC2)C(=O)C1)c1ccccc1
InChIInChI=1S/C16H20N2O2/c1-12(13-5-3-2-4-6-13)16(20)17-9-10-18(14-7-8-14)15(19)11-17/h2-6,12,14H,7-11H2,1H3
InChIKeyMZUFAWKFGUAHRI-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.62
Rot. Bonds3

About 1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one

1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one (PubChem CID 119034196) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one.

Molecular Properties

Compound Name1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one
PubChem CID119034196
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one
SMILESCC(C(=O)N1CCN(C2CC2)C(=O)C1)c1ccccc1
InChIInChI=1S/C16H20N2O2/c1-12(13-5-3-2-4-6-13)16(20)17-9-10-18(14-7-8-14)15(19)11-17/h2-6,12,14H,7-11H2,1H3
InChIKeyMZUFAWKFGUAHRI-UHFFFAOYSA-N
XLogP1.62
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one
CID 94855656
4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one
CID 119326508
4-(2-phenylpropanoyl)piperazine-1-carboxylic acid
CID 123978290
1-cyclopropyl-4-(2-phenylacetyl)piperazin-2-one
CID 110720747
4-[(2S)-2-aminobutanoyl]-1-cyclopropylpiperazin-2-one;hydrochloride
CID 75495697
4-[(2S)-2-cycloheptyloxypropanoyl]-1-cyclopropylpiperazin-2-one
CID 97321014
4-[2-(3-chlorophenyl)-2-hydroxyacetyl]-1-cyclopentylpiperazin-2-one
CID 77082700
1-cyclopentyl-4-[2-(2-fluorophenyl)-2-hydroxyacetyl]piperazin-2-one
CID 77081733
1-cyclopropyl-4-propanoylpiperazin-2-one
CID 110720711
4-[3-amino-2-(4-fluorophenyl)propanoyl]-1-cyclopropylpiperazin-2-one;hydrochloride
CID 120633509
2-phenyl-1-piperazin-1-ylpropan-1-one
CID 52983882
4-cyclopropyl-N,N-diethyl-3-oxopiperazine-1-carboxamide
CID 110873293

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one?
The IUPAC name of 1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one (CID 119034196) is 1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one.
What is the SMILES notation for 1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one?
The canonical SMILES for 1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one is CC(C(=O)N1CCN(C2CC2)C(=O)C1)c1ccccc1.
What is the InChIKey of 1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one?
The InChIKey is MZUFAWKFGUAHRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-12(13-5-3-2-4-6-13)16(20)17-9-10-18(14-7-8-14)15(19)11-17/h2-6,12,14H,7-11H2,1H3.
What are the key properties of 1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one?
1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one has a molecular weight of 272.35 g/mol, XLogP of 1.62, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one is sourced from PubChem (CID 119034196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).