(1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol

C15H27NO — CID 59881048

IUPAC(1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol
SMILESC=C(C)[C@H]1CC[C@@](C)(O)[C@H](N2CCCCC2)C1
InChIInChI=1S/C15H27NO/c1-12(2)13-7-8-15(3,17)14(11-13)16-9-5-4-6-10-16/h13-14,17H,1,4-11H2,2-3H3/t13-,14+,15+/m0/s1
InChIKeyUWOYRXVZLBVWBX-RRFJBIMHSA-N
MW237.39 g/mol
LogP2.97
Rot. Bonds2

About (1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol

(1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol (PubChem CID 59881048) has the molecular formula C15H27NO and a molecular weight of 237.39 g/mol. Its IUPAC name is (1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name(1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol
PubChem CID59881048
Molecular FormulaC15H27NO
Molecular Weight237.39 g/mol
Exact Mass237.21
IUPAC Name(1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol
SMILESC=C(C)[C@H]1CC[C@@](C)(O)[C@H](N2CCCCC2)C1
InChIInChI=1S/C15H27NO/c1-12(2)13-7-8-15(3,17)14(11-13)16-9-5-4-6-10-16/h13-14,17H,1,4-11H2,2-3H3/t13-,14+,15+/m0/s1
InChIKeyUWOYRXVZLBVWBX-RRFJBIMHSA-N
XLogP2.97
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol?
The IUPAC name of (1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol (CID 59881048) is (1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol.
What is the SMILES notation for (1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol?
The canonical SMILES for (1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol is C=C(C)[C@H]1CC[C@@](C)(O)[C@H](N2CCCCC2)C1.
What is the InChIKey of (1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol?
The InChIKey is UWOYRXVZLBVWBX-RRFJBIMHSA-N. The full InChI is InChI=1S/C15H27NO/c1-12(2)13-7-8-15(3,17)14(11-13)16-9-5-4-6-10-16/h13-14,17H,1,4-11H2,2-3H3/t13-,14+,15+/m0/s1.
What are the key properties of (1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol?
(1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol has a molecular weight of 237.39 g/mol, XLogP of 2.97, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R,4S)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol is sourced from PubChem (CID 59881048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).