2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride

C16H34ClNO — CID 71395103

IUPAC2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride
SMILESCCCCCCCCCC1CCN(CCO)CC1.Cl
InChIInChI=1S/C16H33NO.ClH/c1-2-3-4-5-6-7-8-9-16-10-12-17(13-11-16)14-15-18;/h16,18H,2-15H2,1H3;1H
InChIKeyZTLKNNLRSYTDMA-UHFFFAOYSA-N
MW291.91 g/mol
LogP4.25
Rot. Bonds10

About 2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride

2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride (PubChem CID 71395103) has the molecular formula C16H34ClNO and a molecular weight of 291.91 g/mol. Its IUPAC name is 2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride.

Molecular Properties

Compound Name2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride
PubChem CID71395103
Molecular FormulaC16H34ClNO
Molecular Weight291.91 g/mol
Exact Mass291.23
IUPAC Name2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride
SMILESCCCCCCCCCC1CCN(CCO)CC1.Cl
InChIInChI=1S/C16H33NO.ClH/c1-2-3-4-5-6-7-8-9-16-10-12-17(13-11-16)14-15-18;/h16,18H,2-15H2,1H3;1H
InChIKeyZTLKNNLRSYTDMA-UHFFFAOYSA-N
XLogP4.25
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.91
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(4-octylpiperidin-1-yl)butan-1-ol;hydrochloride
CID 71395097
5-(4-hexylpiperidin-1-yl)pentan-1-ol;hydrochloride
CID 23328916
4-(4-octylpiperidin-1-yl)butan-1-ol
CID 71395098
4-(4-nonylpiperidin-1-yl)butan-1-ol
CID 71395100
4-butyl-1-octylpiperidine
CID 171570418
4-butyl-1-heptylpiperidine;formonitrile
CID 175849547
1-methyl-4-[2-(1-pentadecylpiperidin-4-yl)ethyl]piperidine;hydrochloride
CID 45263278
4-butyl-1-hexylpiperidine;methanesulfonic acid
CID 175583852
4-butyl-1-undecylpiperidine;methanesulfonic acid
CID 175583862
2-[4-(3-piperidin-1-ylpropyl)piperidin-1-yl]ethanol
CID 57255409
2-(1-hexylpyrrolidin-3-yl)ethanol
CID 115648154
1-(cyclobutylmethyl)-4-hexylpiperidine
CID 167565501

Frequently Asked Questions

What is the IUPAC name of 2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride?
The IUPAC name of 2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride (CID 71395103) is 2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride.
What is the SMILES notation for 2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride?
The canonical SMILES for 2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride is CCCCCCCCCC1CCN(CCO)CC1.Cl.
What is the InChIKey of 2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride?
The InChIKey is ZTLKNNLRSYTDMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO.ClH/c1-2-3-4-5-6-7-8-9-16-10-12-17(13-11-16)14-15-18;/h16,18H,2-15H2,1H3;1H.
What are the key properties of 2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride?
2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride has a molecular weight of 291.91 g/mol, XLogP of 4.25, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride is sourced from PubChem (CID 71395103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).