piperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol

C15H27NO — CID 143005349

IUPACpiperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol
SMILESCC1=CCC(C)(C(O)N2CCCCC2)C(C)C1
InChIInChI=1S/C15H27NO/c1-12-7-8-15(3,13(2)11-12)14(17)16-9-5-4-6-10-16/h7,13-14,17H,4-6,8-11H2,1-3H3
InChIKeyYSYMRLGXAWOXIK-UHFFFAOYSA-N
MW237.39 g/mol
LogP3.17
Rot. Bonds2

About piperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol

piperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol (PubChem CID 143005349) has the molecular formula C15H27NO and a molecular weight of 237.39 g/mol. Its IUPAC name is piperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol.

Molecular Properties

Compound Namepiperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol
PubChem CID143005349
Molecular FormulaC15H27NO
Molecular Weight237.39 g/mol
Exact Mass237.21
IUPAC Namepiperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol
SMILESCC1=CCC(C)(C(O)N2CCCCC2)C(C)C1
InChIInChI=1S/C15H27NO/c1-12-7-8-15(3,13(2)11-12)14(17)16-9-5-4-6-10-16/h7,13-14,17H,4-6,8-11H2,1-3H3
InChIKeyYSYMRLGXAWOXIK-UHFFFAOYSA-N
XLogP3.17
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 ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze piperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol 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 piperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol?
The IUPAC name of piperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol (CID 143005349) is piperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol.
What is the SMILES notation for piperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol?
The canonical SMILES for piperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol is CC1=CCC(C)(C(O)N2CCCCC2)C(C)C1.
What is the InChIKey of piperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol?
The InChIKey is YSYMRLGXAWOXIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO/c1-12-7-8-15(3,13(2)11-12)14(17)16-9-5-4-6-10-16/h7,13-14,17H,4-6,8-11H2,1-3H3.
What are the key properties of piperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol?
piperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol has a molecular weight of 237.39 g/mol, XLogP of 3.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-1-yl-(1,4,6-trimethylcyclohex-3-en-1-yl)methanol is sourced from PubChem (CID 143005349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).