2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone

C17H24N2O2 — CID 111430178

IUPAC2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone
SMILESO=C(CC1(O)CCCC1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C17H24N2O2/c20-16(14-17(21)8-4-5-9-17)19-12-10-18(11-13-19)15-6-2-1-3-7-15/h1-3,6-7,21H,4-5,8-14H2
InChIKeyIZPZOOOEXHLJKF-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.03
Rot. Bonds3

About 2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone

2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone (PubChem CID 111430178) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone.

Molecular Properties

Compound Name2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone
PubChem CID111430178
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone
SMILESO=C(CC1(O)CCCC1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C17H24N2O2/c20-16(14-17(21)8-4-5-9-17)19-12-10-18(11-13-19)15-6-2-1-3-7-15/h1-3,6-7,21H,4-5,8-14H2
InChIKeyIZPZOOOEXHLJKF-UHFFFAOYSA-N
XLogP2.03
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 ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-hydroxycyclohexyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
CID 111331567
2-cyclohexyl-1-(4-phenylpiperazin-1-yl)ethanone
CID 806694
1,6-bis(4-phenylpiperazin-1-yl)hexane-1,6-dione
CID 2933488
2-hydroxy-1-[(4R)-4-hydroxy-4-[(4-phenylpiperazin-1-yl)methyl]azepan-1-yl]ethanone
CID 124999720
1-(4-phenyl-1,4-diazepan-1-yl)propan-1-one
CID 110873765
3-methyl-1-(4-phenyl-1,4-diazepan-1-yl)butan-1-one
CID 110873770
2-[1-[2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl]cyclopentyl]acetic acid
CID 6734032
2-(3-but-3-ynyldiazirin-3-yl)-1-(4-phenylpiperazin-1-yl)ethanone
CID 139036242
1-amino-N-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119870682
1-(4-phenylpiperazin-1-yl)pentane-1,4-dione
CID 60636215
(1-phenylcyclopentyl)-(4-phenylpiperazin-1-yl)methanone
CID 4048114
1-[4-[2-(1-hydroxycyclopentyl)acetyl]piperazin-1-yl]-2-(4-methylphenyl)ethanone
CID 111432626

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone?
The IUPAC name of 2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone (CID 111430178) is 2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone.
What is the SMILES notation for 2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone?
The canonical SMILES for 2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone is O=C(CC1(O)CCCC1)N1CCN(c2ccccc2)CC1.
What is the InChIKey of 2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone?
The InChIKey is IZPZOOOEXHLJKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c20-16(14-17(21)8-4-5-9-17)19-12-10-18(11-13-19)15-6-2-1-3-7-15/h1-3,6-7,21H,4-5,8-14H2.
What are the key properties of 2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone?
2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone has a molecular weight of 288.39 g/mol, XLogP of 2.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxycyclopentyl)-1-(4-phenylpiperazin-1-yl)ethanone is sourced from PubChem (CID 111430178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).