1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol

C12H21NO — CID 2845911

IUPAC1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol
SMILESOC1CCCN(CC2CC=CCC2)C1
InChIInChI=1S/C12H21NO/c14-12-7-4-8-13(10-12)9-11-5-2-1-3-6-11/h1-2,11-12,14H,3-10H2
InChIKeyLFAHAZYKDALXSI-UHFFFAOYSA-N
MW195.31 g/mol
LogP1.80
Rot. Bonds2

About 1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol

1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol (PubChem CID 2845911) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is 1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol.

Molecular Properties

Compound Name1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol
PubChem CID2845911
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC Name1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol
SMILESOC1CCCN(CC2CC=CCC2)C1
InChIInChI=1S/C12H21NO/c14-12-7-4-8-13(10-12)9-11-5-2-1-3-6-11/h1-2,11-12,14H,3-10H2
InChIKeyLFAHAZYKDALXSI-UHFFFAOYSA-N
XLogP1.80
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 51.80
H-Bond Donors ≤ 51
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 1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol?
The IUPAC name of 1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol (CID 2845911) is 1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol.
What is the SMILES notation for 1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol?
The canonical SMILES for 1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol is OC1CCCN(CC2CC=CCC2)C1.
What is the InChIKey of 1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol?
The InChIKey is LFAHAZYKDALXSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO/c14-12-7-4-8-13(10-12)9-11-5-2-1-3-6-11/h1-2,11-12,14H,3-10H2.
What are the key properties of 1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol?
1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol has a molecular weight of 195.31 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohex-3-en-1-ylmethyl)piperidin-3-ol is sourced from PubChem (CID 2845911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).