2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone

C18H24N2O2 — CID 110366202

IUPAC2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone
SMILESO=C(CN1CCN(C(=O)C2CCCC2)CC1)c1ccccc1
InChIInChI=1S/C18H24N2O2/c21-17(15-6-2-1-3-7-15)14-19-10-12-20(13-11-19)18(22)16-8-4-5-9-16/h1-3,6-7,16H,4-5,8-14H2
InChIKeyPZBJWBMCPDPHAD-UHFFFAOYSA-N
MW300.40 g/mol
LogP2.20
Rot. Bonds4

About 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone

2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone (PubChem CID 110366202) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone.

Molecular Properties

Compound Name2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone
PubChem CID110366202
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone
SMILESO=C(CN1CCN(C(=O)C2CCCC2)CC1)c1ccccc1
InChIInChI=1S/C18H24N2O2/c21-17(15-6-2-1-3-7-15)14-19-10-12-20(13-11-19)18(22)16-8-4-5-9-16/h1-3,6-7,16H,4-5,8-14H2
InChIKeyPZBJWBMCPDPHAD-UHFFFAOYSA-N
XLogP2.20
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylbutan-1-one
CID 110398502
2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-(4-propan-2-ylphenyl)ethanone
CID 110366829
2-(4-benzoylpiperazin-1-yl)-1-phenylethanone
CID 3599210
2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-(4-fluoro-3-methylphenyl)ethanone
CID 110366432
2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-(1H-indol-3-yl)ethanone
CID 36880743
(4-benzyl-1,4-diazepan-1-yl)-cyclopentylmethanone
CID 23939190
N-benzyl-2-[4-(cyclopentanecarbonyl)-1,4-diazepan-1-yl]acetamide
CID 137341250
1-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-phenylethanone
CID 110364750
N-[2-[4-(cyclohexanecarbonyl)piperazin-1-yl]-2-oxoethyl]benzamide
CID 110801022
2-[4-(cyclohexanecarbonyl)piperazin-1-yl]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone
CID 128950944
2-[4-(cyclohexanecarbonyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide
CID 86850419
3-methyl-1-(4-phenacylpiperazin-1-yl)butan-1-one
CID 110366198

Frequently Asked Questions

What is the IUPAC name of 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone?
The IUPAC name of 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone (CID 110366202) is 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone.
What is the SMILES notation for 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone?
The canonical SMILES for 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone is O=C(CN1CCN(C(=O)C2CCCC2)CC1)c1ccccc1.
What is the InChIKey of 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone?
The InChIKey is PZBJWBMCPDPHAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c21-17(15-6-2-1-3-7-15)14-19-10-12-20(13-11-19)18(22)16-8-4-5-9-16/h1-3,6-7,16H,4-5,8-14H2.
What are the key properties of 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone?
2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone has a molecular weight of 300.40 g/mol, XLogP of 2.20, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone is sourced from PubChem (CID 110366202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).