2-(1-octylpiperidin-2-yl)ethanol

C15H31NO — CID 62020097

IUPAC2-(1-octylpiperidin-2-yl)ethanol
SMILESCCCCCCCCN1CCCCC1CCO
InChIInChI=1S/C15H31NO/c1-2-3-4-5-6-8-12-16-13-9-7-10-15(16)11-14-17/h15,17H,2-14H2,1H3
InChIKeyNABRZXMICSUFMW-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.58
Rot. Bonds9

About 2-(1-octylpiperidin-2-yl)ethanol

2-(1-octylpiperidin-2-yl)ethanol (PubChem CID 62020097) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 2-(1-octylpiperidin-2-yl)ethanol.

Molecular Properties

Compound Name2-(1-octylpiperidin-2-yl)ethanol
PubChem CID62020097
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name2-(1-octylpiperidin-2-yl)ethanol
SMILESCCCCCCCCN1CCCCC1CCO
InChIInChI=1S/C15H31NO/c1-2-3-4-5-6-8-12-16-13-9-7-10-15(16)11-14-17/h15,17H,2-14H2,1H3
InChIKeyNABRZXMICSUFMW-UHFFFAOYSA-N
XLogP3.58
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(1-octylpiperidin-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

Related Compounds

2-(1-pentylpyrrolidin-2-yl)ethanol
CID 117028513
6-[2-(2-hydroxyethyl)piperidin-1-yl]hexan-1-ol
CID 103737919
2-butyl-1-hexylpiperidine
CID 171569565
2-butyl-1-hexylpiperidine;hydrofluoride
CID 175874869
1-pentyl-2-propylpiperidine
CID 54429991
2-(1-hexylpiperidin-2-yl)ethanamine
CID 63759699
1-dodecyl-2-ethylpiperidine
CID 171569899
2-ethyl-1-nonylpiperidine;hydrofluoride
CID 175849535
[(2R)-1-heptylpyrrolidin-2-yl]methanol
CID 64982587
[(2S)-1-decylpyrrolidin-2-yl]methanol
CID 79003239
(1-dodecylpyrrolidin-2-yl)methanol
CID 63468146
1-decyl-2-propylpyrrolidine;hydrochloride
CID 175874875

Frequently Asked Questions

What is the IUPAC name of 2-(1-octylpiperidin-2-yl)ethanol?
The IUPAC name of 2-(1-octylpiperidin-2-yl)ethanol (CID 62020097) is 2-(1-octylpiperidin-2-yl)ethanol.
What is the SMILES notation for 2-(1-octylpiperidin-2-yl)ethanol?
The canonical SMILES for 2-(1-octylpiperidin-2-yl)ethanol is CCCCCCCCN1CCCCC1CCO.
What is the InChIKey of 2-(1-octylpiperidin-2-yl)ethanol?
The InChIKey is NABRZXMICSUFMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-2-3-4-5-6-8-12-16-13-9-7-10-15(16)11-14-17/h15,17H,2-14H2,1H3.
What are the key properties of 2-(1-octylpiperidin-2-yl)ethanol?
2-(1-octylpiperidin-2-yl)ethanol has a molecular weight of 241.42 g/mol, XLogP of 3.58, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-octylpiperidin-2-yl)ethanol is sourced from PubChem (CID 62020097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).