2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol

C18H34N2O — CID 62708468

IUPAC2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1CCC(O)C(N2CCN(C3CCCC3)CC2)C1
InChIInChI=1S/C18H34N2O/c1-14(2)15-7-8-18(21)17(13-15)20-11-9-19(10-12-20)16-5-3-4-6-16/h14-18,21H,3-13H2,1-2H3
InChIKeyRAOCOPSFRNKBQS-UHFFFAOYSA-N
MW294.48 g/mol
LogP2.73
Rot. Bonds3

About 2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol

2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol (PubChem CID 62708468) has the molecular formula C18H34N2O and a molecular weight of 294.48 g/mol. Its IUPAC name is 2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol
PubChem CID62708468
Molecular FormulaC18H34N2O
Molecular Weight294.48 g/mol
Exact Mass294.27
IUPAC Name2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1CCC(O)C(N2CCN(C3CCCC3)CC2)C1
InChIInChI=1S/C18H34N2O/c1-14(2)15-7-8-18(21)17(13-15)20-11-9-19(10-12-20)16-5-3-4-6-16/h14-18,21H,3-13H2,1-2H3
InChIKeyRAOCOPSFRNKBQS-UHFFFAOYSA-N
XLogP2.73
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.48
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-4-propan-2-ylcyclohexan-1-ol
CID 79934726
2-(4-tert-butylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol
CID 62704133
2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol
CID 62931964
2-(4,4-dimethylazepan-1-yl)-4-propan-2-ylcyclohexan-1-ol
CID 65281648
2-(3-methylpyrrolidin-1-yl)-4-propan-2-ylcyclohexan-1-ol
CID 62707731
2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-4-propan-2-ylcyclohexan-1-ol
CID 79174564
2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-4-propan-2-ylcyclohexan-1-amine
CID 79938659
2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-4-ethylcyclohexan-1-ol
CID 79935309
4-propan-2-ylcyclopentane-1,2-diol
CID 20608687
ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine
CID 171508742
1-cyclohexylazetidine;2-methylpropane
CID 178017193
1,4-dicyclohexyl-7-[1-(4,7-dicyclohexyl-1,4,7-triazonan-1-yl)ethyl]-1,4,7-triazonane
CID 23439594

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol (CID 62708468) is 2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol is CC(C)C1CCC(O)C(N2CCN(C3CCCC3)CC2)C1.
What is the InChIKey of 2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol?
The InChIKey is RAOCOPSFRNKBQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O/c1-14(2)15-7-8-18(21)17(13-15)20-11-9-19(10-12-20)16-5-3-4-6-16/h14-18,21H,3-13H2,1-2H3.
What are the key properties of 2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol?
2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol has a molecular weight of 294.48 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 62708468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).