1-piperidin-4-ylundecan-1-ol

C16H33NO — CID 80560155

IUPAC1-piperidin-4-ylundecan-1-ol
SMILESCCCCCCCCCCC(O)C1CCNCC1
InChIInChI=1S/C16H33NO/c1-2-3-4-5-6-7-8-9-10-16(18)15-11-13-17-14-12-15/h15-18H,2-14H2,1H3
InChIKeyOXYRQCWTNWHDTP-UHFFFAOYSA-N
MW255.45 g/mol
LogP3.88
Rot. Bonds10

About 1-piperidin-4-ylundecan-1-ol

1-piperidin-4-ylundecan-1-ol (PubChem CID 80560155) has the molecular formula C16H33NO and a molecular weight of 255.45 g/mol. Its IUPAC name is 1-piperidin-4-ylundecan-1-ol.

Molecular Properties

Compound Name1-piperidin-4-ylundecan-1-ol
PubChem CID80560155
Molecular FormulaC16H33NO
Molecular Weight255.45 g/mol
Exact Mass255.26
IUPAC Name1-piperidin-4-ylundecan-1-ol
SMILESCCCCCCCCCCC(O)C1CCNCC1
InChIInChI=1S/C16H33NO/c1-2-3-4-5-6-7-8-9-10-16(18)15-11-13-17-14-12-15/h15-18H,2-14H2,1H3
InChIKeyOXYRQCWTNWHDTP-UHFFFAOYSA-N
XLogP3.88
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-piperidin-4-ylpentan-1-ol
CID 19599407
1-cyclopropyltetradecan-1-ol
CID 63461268
1-cyclopropylheptan-1-ol
CID 10909821
1-cyclopropyltridecan-1-ol
CID 63410999
1-cyclooctylundecan-1-ol
CID 80603651
4-(1-fluoroundecyl)piperidine
CID 112563659
1-cyclopropylpentan-1-ol
CID 551238
4-ethylsulfonyl-1-piperidin-4-ylbutan-1-ol
CID 80560105
4-heptan-2-ylpiperidine
CID 143122379
1-(3-bicyclo[3.1.0]hexanyl)tridecan-1-ol
CID 115789478
1-(4-tert-butylcyclohexyl)heptan-1-ol
CID 65400919
4-methylsulfonyl-1-piperidin-4-ylbutan-1-ol
CID 80560226

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-4-ylundecan-1-ol?
The IUPAC name of 1-piperidin-4-ylundecan-1-ol (CID 80560155) is 1-piperidin-4-ylundecan-1-ol.
What is the SMILES notation for 1-piperidin-4-ylundecan-1-ol?
The canonical SMILES for 1-piperidin-4-ylundecan-1-ol is CCCCCCCCCCC(O)C1CCNCC1.
What is the InChIKey of 1-piperidin-4-ylundecan-1-ol?
The InChIKey is OXYRQCWTNWHDTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO/c1-2-3-4-5-6-7-8-9-10-16(18)15-11-13-17-14-12-15/h15-18H,2-14H2,1H3.
What are the key properties of 1-piperidin-4-ylundecan-1-ol?
1-piperidin-4-ylundecan-1-ol has a molecular weight of 255.45 g/mol, XLogP of 3.88, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-4-ylundecan-1-ol is sourced from PubChem (CID 80560155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).