trans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol

C11H21NO — CID 102734292

IUPACtrans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol
SMILESCC1CCCCN1[C@H]1CCC[C@@H]1O
InChIInChI=1S/C11H21NO/c1-9-5-2-3-8-12(9)10-6-4-7-11(10)13/h9-11,13H,2-8H2,1H3/t9?,10-,11-/m0/s1
InChIKeyJFNSDEHZCFKJBQ-DVRYWGNFSA-N
MW183.29 g/mol
LogP1.77
Rot. Bonds1

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

trans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol (PubChem CID 102734292) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is trans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol
PubChem CID102734292
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Nametrans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol
SMILESCC1CCCCN1[C@H]1CCC[C@@H]1O
InChIInChI=1S/C11H21NO/c1-9-5-2-3-8-12(9)10-6-4-7-11(10)13/h9-11,13H,2-8H2,1H3/t9?,10-,11-/m0/s1
InChIKeyJFNSDEHZCFKJBQ-DVRYWGNFSA-N
XLogP1.77
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of trans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol?
The IUPAC name of trans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol (CID 102734292) is trans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol.
What is the SMILES notation for trans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol?
The canonical SMILES for trans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol is CC1CCCCN1[C@H]1CCC[C@@H]1O.
What is the InChIKey of trans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol?
The InChIKey is JFNSDEHZCFKJBQ-DVRYWGNFSA-N. The full InChI is InChI=1S/C11H21NO/c1-9-5-2-3-8-12(9)10-6-4-7-11(10)13/h9-11,13H,2-8H2,1H3/t9?,10-,11-/m0/s1.
What are the key properties of trans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol?
trans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol has a molecular weight of 183.29 g/mol, XLogP of 1.77, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol is sourced from PubChem (CID 102734292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).