trans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol

C11H22N2O — CID 102734329

IUPACtrans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol
SMILESCCN1CCN([C@H]2CCC[C@@H]2O)CC1
InChIInChI=1S/C11H22N2O/c1-2-12-6-8-13(9-7-12)10-4-3-5-11(10)14/h10-11,14H,2-9H2,1H3/t10-,11-/m0/s1
InChIKeyYJDCMWPIWBEHAD-QWRGUYRKSA-N
MW198.31 g/mol
LogP0.54
Rot. Bonds2

About trans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol

trans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol (PubChem CID 102734329) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is trans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol
PubChem CID102734329
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Nametrans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol
SMILESCCN1CCN([C@H]2CCC[C@@H]2O)CC1
InChIInChI=1S/C11H22N2O/c1-2-12-6-8-13(9-7-12)10-4-3-5-11(10)14/h10-11,14H,2-9H2,1H3/t10-,11-/m0/s1
InChIKeyYJDCMWPIWBEHAD-QWRGUYRKSA-N
XLogP0.54
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cis-(1S,2R)-2-pyrrolidin-1-ylcyclopentan-1-ol
CID 93317277
trans-(1R,2R)-2-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol
CID 102734677
trans-(1S,2S)-2-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol
CID 102734676
trans-(1S,2S)-2-piperidin-1-ylcyclopentan-1-ol
CID 54511107
2-(4-methylpiperidin-1-yl)cyclopentan-1-ol
CID 60712204
cis-(1S,2R)-2-(4-methylpiperazin-1-yl)cyclohexan-1-ol
CID 129365578
trans-(1R,2R)-2-(4-methylpiperazin-1-yl)cyclohexan-1-ol
CID 13447994
trans-(1S,2S)-2-(4-ethoxypiperidin-1-yl)cyclopentan-1-ol
CID 102734432
trans-(1R,2R)-2-(4-ethylazepan-1-yl)cyclopentan-1-ol
CID 102734787
1-[(1R,2R)-2-hydroxycyclopentyl]piperidin-4-ol
CID 102734322
trans-(1R,2R)-2-pyrrolidin-1-ylcyclohexan-1-ol
CID 10103566
cis-(1S,2R)-2-pyrrolidin-1-ylcyclohexan-1-ol
CID 23656399

Frequently Asked Questions

What is the IUPAC name of trans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol?
The IUPAC name of trans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol (CID 102734329) is trans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol.
What is the SMILES notation for trans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol?
The canonical SMILES for trans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol is CCN1CCN([C@H]2CCC[C@@H]2O)CC1.
What is the InChIKey of trans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol?
The InChIKey is YJDCMWPIWBEHAD-QWRGUYRKSA-N. The full InChI is InChI=1S/C11H22N2O/c1-2-12-6-8-13(9-7-12)10-4-3-5-11(10)14/h10-11,14H,2-9H2,1H3/t10-,11-/m0/s1.
What are the key properties of trans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol?
trans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol has a molecular weight of 198.31 g/mol, XLogP of 0.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol is sourced from PubChem (CID 102734329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).