3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol

C11H19NO — CID 164752166

IUPAC3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol
SMILESCC1CCC(C2=CC(O)CC2)NC1
InChIInChI=1S/C11H19NO/c1-8-2-5-11(12-7-8)9-3-4-10(13)6-9/h6,8,10-13H,2-5,7H2,1H3
InChIKeyDFTSUJGJKPOKGT-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.46
Rot. Bonds1

About 3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol

3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol (PubChem CID 164752166) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol.

Molecular Properties

Compound Name3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol
PubChem CID164752166
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol
SMILESCC1CCC(C2=CC(O)CC2)NC1
InChIInChI=1S/C11H19NO/c1-8-2-5-11(12-7-8)9-3-4-10(13)6-9/h6,8,10-13H,2-5,7H2,1H3
InChIKeyDFTSUJGJKPOKGT-UHFFFAOYSA-N
XLogP1.46
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol?
The IUPAC name of 3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol (CID 164752166) is 3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol.
What is the SMILES notation for 3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol?
The canonical SMILES for 3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol is CC1CCC(C2=CC(O)CC2)NC1.
What is the InChIKey of 3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol?
The InChIKey is DFTSUJGJKPOKGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-8-2-5-11(12-7-8)9-3-4-10(13)6-9/h6,8,10-13H,2-5,7H2,1H3.
What are the key properties of 3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol?
3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol has a molecular weight of 181.28 g/mol, XLogP of 1.46, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methylpiperidin-2-yl)cyclopent-2-en-1-ol is sourced from PubChem (CID 164752166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).