10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol

C16H34NO+ — CID 89438831

IUPAC10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol
SMILESC[N+]1(CCCCCCCCCCO)CCCCC1
InChIInChI=1S/C16H34NO/c1-17(14-10-8-11-15-17)13-9-6-4-2-3-5-7-12-16-18/h18H,2-16H2,1H3/q+1
InChIKeyUFALTDSYPNWCEG-UHFFFAOYSA-N
MW256.45 g/mol
LogP3.73
Rot. Bonds10

About 10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol

10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol (PubChem CID 89438831) has the molecular formula C16H34NO+ and a molecular weight of 256.45 g/mol. Its IUPAC name is 10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol.

Molecular Properties

Compound Name10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol
PubChem CID89438831
Molecular FormulaC16H34NO+
Molecular Weight256.45 g/mol
Exact Mass256.26
IUPAC Name10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol
SMILESC[N+]1(CCCCCCCCCCO)CCCCC1
InChIInChI=1S/C16H34NO/c1-17(14-10-8-11-15-17)13-9-6-4-2-3-5-7-12-16-18/h18H,2-16H2,1H3/q+1
InChIKeyUFALTDSYPNWCEG-UHFFFAOYSA-N
XLogP3.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.45
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

6-(1-methylpiperidin-1-ium-1-yl)hexan-1-ol bromide
CID 89439291
4-(1-methylpyrrolidin-1-ium-1-yl)butan-1-ol
CID 68798681
1-methyl-1-[10-(1-methylpiperidin-1-ium-1-yl)decyl]piperidin-1-ium
CID 3048054
1-methyl-1-[16-(1-methylpyrrolidin-1-ium-1-yl)hexadecyl]pyrrolidin-1-ium
CID 10650384
1-methyl-1-[6-(1-methylpyrrolidin-1-ium-1-yl)hexyl]pyrrolidin-1-ium dihydroxide
CID 156717813
1-methyl-1-[5-(1-methylpyrrolidin-1-ium-1-yl)pentyl]pyrrolidin-1-ium bromide
CID 156595016
1-hexadecyl-1-methylazocan-1-ium bromide
CID 44612945
2-(1-methylpyrrolidin-1-ium-1-yl)ethanol iodide
CID 10539047
9-(1-methylpyrrolidin-1-ium-1-yl)nonane-1-thiol
CID 118937449
5-(1-propylpiperidin-1-ium-1-yl)pentan-1-ol
CID 155168800
1,1-diethylpyrrolidin-1-ium;1-ethyl-1-[6-(1-ethylpiperidin-1-ium-1-yl)hexyl]piperidin-1-ium;1-ethyl-1-[5-(1-methylpiperidin-1-ium-1-yl)pentyl]piperidin-1-ium
CID 158691923
1-methyl-1-undecylpyrrolidin-1-ium cyanide
CID 171570218

Frequently Asked Questions

What is the IUPAC name of 10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol?
The IUPAC name of 10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol (CID 89438831) is 10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol.
What is the SMILES notation for 10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol?
The canonical SMILES for 10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol is C[N+]1(CCCCCCCCCCO)CCCCC1.
What is the InChIKey of 10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol?
The InChIKey is UFALTDSYPNWCEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34NO/c1-17(14-10-8-11-15-17)13-9-6-4-2-3-5-7-12-16-18/h18H,2-16H2,1H3/q+1.
What are the key properties of 10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol?
10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol has a molecular weight of 256.45 g/mol, XLogP of 3.73, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(1-methylpiperidin-1-ium-1-yl)decan-1-ol is sourced from PubChem (CID 89438831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).