1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol

C15H29NO — CID 75496940

IUPAC1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol
SMILESCC1CCC(CN2CCCCC2C(C)O)CC1
InChIInChI=1S/C15H29NO/c1-12-6-8-14(9-7-12)11-16-10-4-3-5-15(16)13(2)17/h12-15,17H,3-11H2,1-2H3
InChIKeyFXTMDQCUWJVOJS-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.05
Rot. Bonds3

About 1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol

1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol (PubChem CID 75496940) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol.

Molecular Properties

Compound Name1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol
PubChem CID75496940
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol
SMILESCC1CCC(CN2CCCCC2C(C)O)CC1
InChIInChI=1S/C15H29NO/c1-12-6-8-14(9-7-12)11-16-10-4-3-5-15(16)13(2)17/h12-15,17H,3-11H2,1-2H3
InChIKeyFXTMDQCUWJVOJS-UHFFFAOYSA-N
XLogP3.05
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol 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 1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol?
The IUPAC name of 1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol (CID 75496940) is 1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol.
What is the SMILES notation for 1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol?
The canonical SMILES for 1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol is CC1CCC(CN2CCCCC2C(C)O)CC1.
What is the InChIKey of 1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol?
The InChIKey is FXTMDQCUWJVOJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-12-6-8-14(9-7-12)11-16-10-4-3-5-15(16)13(2)17/h12-15,17H,3-11H2,1-2H3.
What are the key properties of 1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol?
1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol has a molecular weight of 239.40 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(4-methylcyclohexyl)methyl]piperidin-2-yl]ethanol is sourced from PubChem (CID 75496940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).