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

C12H23NO2 — CID 102734432

IUPACtrans-(1S,2S)-2-(4-ethoxypiperidin-1-yl)cyclopentan-1-ol
SMILESCCOC1CCN([C@H]2CCC[C@@H]2O)CC1
InChIInChI=1S/C12H23NO2/c1-2-15-10-6-8-13(9-7-10)11-4-3-5-12(11)14/h10-12,14H,2-9H2,1H3/t11-,12-/m0/s1
InChIKeyZGOVTDNNJRZUQL-RYUDHWBXSA-N
MW213.32 g/mol
LogP1.40
Rot. Bonds3

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

trans-(1S,2S)-2-(4-ethoxypiperidin-1-yl)cyclopentan-1-ol (PubChem CID 102734432) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is trans-(1S,2S)-2-(4-ethoxypiperidin-1-yl)cyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1S,2S)-2-(4-ethoxypiperidin-1-yl)cyclopentan-1-ol
PubChem CID102734432
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Nametrans-(1S,2S)-2-(4-ethoxypiperidin-1-yl)cyclopentan-1-ol
SMILESCCOC1CCN([C@H]2CCC[C@@H]2O)CC1
InChIInChI=1S/C12H23NO2/c1-2-15-10-6-8-13(9-7-10)11-4-3-5-12(11)14/h10-12,14H,2-9H2,1H3/t11-,12-/m0/s1
InChIKeyZGOVTDNNJRZUQL-RYUDHWBXSA-N
XLogP1.40
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

trans-(1S,2S)-2-(3-ethoxypiperidin-1-yl)cyclohexan-1-ol
CID 102732019
trans-(1S,2S)-2-[4-(2-hydroxyethoxy)piperidin-1-yl]cyclohexan-1-ol
CID 102732265
2-(4-methylpiperidin-1-yl)cyclopentan-1-ol
CID 60712204
1-[(1R,2R)-2-hydroxycyclopentyl]piperidin-4-ol
CID 102734322
trans-(1S,2S)-2-(4-ethylpiperazin-1-yl)cyclopentan-1-ol
CID 102734329
cis-(1S,2R)-2-pyrrolidin-1-ylcyclopentan-1-ol
CID 93317277
trans-(1R,2R)-2-(4-ethylazepan-1-yl)cyclopentan-1-ol
CID 102734787
trans-(1S,2S)-2-piperidin-1-ylcyclopentan-1-ol
CID 54511107
trans-(1R,2R)-2-(3-methoxypyrrolidin-1-yl)cyclohexan-1-ol
CID 103536869
2-(4-methylazepan-1-yl)cyclopentan-1-ol
CID 63622455
2-(4-propylpiperidin-1-yl)cycloheptan-1-ol
CID 62205599
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-ethoxypiperidin-1-yl)cyclopentan-1-ol?
The IUPAC name of trans-(1S,2S)-2-(4-ethoxypiperidin-1-yl)cyclopentan-1-ol (CID 102734432) is trans-(1S,2S)-2-(4-ethoxypiperidin-1-yl)cyclopentan-1-ol.
What is the SMILES notation for trans-(1S,2S)-2-(4-ethoxypiperidin-1-yl)cyclopentan-1-ol?
The canonical SMILES for trans-(1S,2S)-2-(4-ethoxypiperidin-1-yl)cyclopentan-1-ol is CCOC1CCN([C@H]2CCC[C@@H]2O)CC1.
What is the InChIKey of trans-(1S,2S)-2-(4-ethoxypiperidin-1-yl)cyclopentan-1-ol?
The InChIKey is ZGOVTDNNJRZUQL-RYUDHWBXSA-N. The full InChI is InChI=1S/C12H23NO2/c1-2-15-10-6-8-13(9-7-10)11-4-3-5-12(11)14/h10-12,14H,2-9H2,1H3/t11-,12-/m0/s1.
What are the key properties of trans-(1S,2S)-2-(4-ethoxypiperidin-1-yl)cyclopentan-1-ol?
trans-(1S,2S)-2-(4-ethoxypiperidin-1-yl)cyclopentan-1-ol has a molecular weight of 213.32 g/mol, XLogP of 1.40, 3 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-ethoxypiperidin-1-yl)cyclopentan-1-ol is sourced from PubChem (CID 102734432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).