2-(1-hept-6-enylpiperidin-2-yl)ethanol

C14H27NO — CID 107010082

IUPAC2-(1-hept-6-enylpiperidin-2-yl)ethanol
SMILESC=CCCCCCN1CCCCC1CCO
InChIInChI=1S/C14H27NO/c1-2-3-4-5-7-11-15-12-8-6-9-14(15)10-13-16/h2,14,16H,1,3-13H2
InChIKeyQMXCPCUFWGMQQR-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.97
Rot. Bonds8

About 2-(1-hept-6-enylpiperidin-2-yl)ethanol

2-(1-hept-6-enylpiperidin-2-yl)ethanol (PubChem CID 107010082) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2-(1-hept-6-enylpiperidin-2-yl)ethanol.

Molecular Properties

Compound Name2-(1-hept-6-enylpiperidin-2-yl)ethanol
PubChem CID107010082
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2-(1-hept-6-enylpiperidin-2-yl)ethanol
SMILESC=CCCCCCN1CCCCC1CCO
InChIInChI=1S/C14H27NO/c1-2-3-4-5-7-11-15-12-8-6-9-14(15)10-13-16/h2,14,16H,1,3-13H2
InChIKeyQMXCPCUFWGMQQR-UHFFFAOYSA-N
XLogP2.97
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(1-hept-6-enylpiperidin-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

6-[2-(2-hydroxyethyl)piperidin-1-yl]hexan-1-ol
CID 103737919
2-(1-octylpiperidin-2-yl)ethanol
CID 62020097
2-[1-(3-fluoropropyl)piperidin-2-yl]ethanol
CID 81113088
1-(1-pent-4-enylpiperidin-2-yl)propan-2-ol
CID 114338062
1-(1-hept-6-enylpyrrolidin-2-yl)-N-methylmethanamine
CID 107008070
2-(1-pentylpyrrolidin-2-yl)ethanol
CID 117028513
2-(1-prop-2-enylpyrrolidin-2-yl)ethanol
CID 117028490
3-[(2R)-2-(2-hydroxyethyl)piperidin-1-yl]propanoic acid
CID 29295033
2-[1-(3-methylbut-3-enyl)piperidin-2-yl]ethanol
CID 114448957
2-[(2S)-1-ethylpiperidin-2-yl]ethanol
CID 26365884
4-(2-ethylpiperidin-1-yl)butan-1-ol
CID 43509675
2-butyl-1-hexylpiperidine
CID 171569565

Frequently Asked Questions

What is the IUPAC name of 2-(1-hept-6-enylpiperidin-2-yl)ethanol?
The IUPAC name of 2-(1-hept-6-enylpiperidin-2-yl)ethanol (CID 107010082) is 2-(1-hept-6-enylpiperidin-2-yl)ethanol.
What is the SMILES notation for 2-(1-hept-6-enylpiperidin-2-yl)ethanol?
The canonical SMILES for 2-(1-hept-6-enylpiperidin-2-yl)ethanol is C=CCCCCCN1CCCCC1CCO.
What is the InChIKey of 2-(1-hept-6-enylpiperidin-2-yl)ethanol?
The InChIKey is QMXCPCUFWGMQQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-2-3-4-5-7-11-15-12-8-6-9-14(15)10-13-16/h2,14,16H,1,3-13H2.
What are the key properties of 2-(1-hept-6-enylpiperidin-2-yl)ethanol?
2-(1-hept-6-enylpiperidin-2-yl)ethanol has a molecular weight of 225.38 g/mol, XLogP of 2.97, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hept-6-enylpiperidin-2-yl)ethanol is sourced from PubChem (CID 107010082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).