1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone

C17H24N2O2 — CID 111432279

IUPAC1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone
SMILESO=C(C(O)c1ccccc1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C17H24N2O2/c20-16(14-6-2-1-3-7-14)17(21)19-12-10-18(11-13-19)15-8-4-5-9-15/h1-3,6-7,15-16,20H,4-5,8-13H2
InChIKeyGKGLFXSWYOQLFU-UHFFFAOYSA-N
MW288.39 g/mol
LogP1.81
Rot. Bonds3

About 1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone

1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone (PubChem CID 111432279) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone.

Molecular Properties

Compound Name1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone
PubChem CID111432279
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone
SMILESO=C(C(O)c1ccccc1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C17H24N2O2/c20-16(14-6-2-1-3-7-14)17(21)19-12-10-18(11-13-19)15-8-4-5-9-15/h1-3,6-7,15-16,20H,4-5,8-13H2
InChIKeyGKGLFXSWYOQLFU-UHFFFAOYSA-N
XLogP1.81
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-cyclopentylpiperazin-1-yl)-2-phenylpentan-1-one
CID 55584335
(2R)-2-hydroxy-2-phenyl-1-piperidin-1-ylethanone
CID 25233871
(2S)-2-hydroxy-2-phenyl-1-piperidin-1-ylethanone
CID 11257941
3-amino-1-(4-cyclopentyl-1,4-diazepan-1-yl)-2-methyl-3-phenylpropan-1-one;dihydrochloride
CID 119871606
2-hydroxy-1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-phenylethanone
CID 111539102
2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone
CID 55583808
(2R)-1-(4-cyclohexylpiperazin-1-yl)-2-phenoxypropan-1-one
CID 42561059
2-(4-benzhydrylpiperazin-1-yl)-1-(4-cyclopentylpiperazin-1-yl)ethanone
CID 57442367
1-[4-(2-cyclopropyl-2-oxoethyl)piperazin-1-yl]-2-hydroxy-2-phenylethanone
CID 111538793
2-amino-1-[4-(4-methylcyclohexyl)piperazin-1-yl]-2-phenylethanone
CID 119887445
(2S)-2-amino-1-(4-cyclobutylpiperazin-1-yl)-3-phenylpropan-1-one
CID 119887152
1-(3-aminopyrrolidin-1-yl)-2-hydroxy-2-phenylethanone
CID 62068275

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone?
The IUPAC name of 1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone (CID 111432279) is 1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone.
What is the SMILES notation for 1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone?
The canonical SMILES for 1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone is O=C(C(O)c1ccccc1)N1CCN(C2CCCC2)CC1.
What is the InChIKey of 1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone?
The InChIKey is GKGLFXSWYOQLFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c20-16(14-6-2-1-3-7-14)17(21)19-12-10-18(11-13-19)15-8-4-5-9-15/h1-3,6-7,15-16,20H,4-5,8-13H2.
What are the key properties of 1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone?
1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone has a molecular weight of 288.39 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone is sourced from PubChem (CID 111432279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).