3-dodecylpiperidin-4-ol

C17H35NO — CID 114451785

IUPAC3-dodecylpiperidin-4-ol
SMILESCCCCCCCCCCCCC1CNCCC1O
InChIInChI=1S/C17H35NO/c1-2-3-4-5-6-7-8-9-10-11-12-16-15-18-14-13-17(16)19/h16-19H,2-15H2,1H3
InChIKeyGMSUBBLUUUEVSN-UHFFFAOYSA-N
MW269.47 g/mol
LogP4.27
Rot. Bonds11

About 3-dodecylpiperidin-4-ol

3-dodecylpiperidin-4-ol (PubChem CID 114451785) has the molecular formula C17H35NO and a molecular weight of 269.47 g/mol. Its IUPAC name is 3-dodecylpiperidin-4-ol.

Molecular Properties

Compound Name3-dodecylpiperidin-4-ol
PubChem CID114451785
Molecular FormulaC17H35NO
Molecular Weight269.47 g/mol
Exact Mass269.27
IUPAC Name3-dodecylpiperidin-4-ol
SMILESCCCCCCCCCCCCC1CNCCC1O
InChIInChI=1S/C17H35NO/c1-2-3-4-5-6-7-8-9-10-11-12-16-15-18-14-13-17(16)19/h16-19H,2-15H2,1H3
InChIKeyGMSUBBLUUUEVSN-UHFFFAOYSA-N
XLogP4.27
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.47
LogP ≤ 54.27
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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Frequently Asked Questions

What is the IUPAC name of 3-dodecylpiperidin-4-ol?
The IUPAC name of 3-dodecylpiperidin-4-ol (CID 114451785) is 3-dodecylpiperidin-4-ol.
What is the SMILES notation for 3-dodecylpiperidin-4-ol?
The canonical SMILES for 3-dodecylpiperidin-4-ol is CCCCCCCCCCCCC1CNCCC1O.
What is the InChIKey of 3-dodecylpiperidin-4-ol?
The InChIKey is GMSUBBLUUUEVSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35NO/c1-2-3-4-5-6-7-8-9-10-11-12-16-15-18-14-13-17(16)19/h16-19H,2-15H2,1H3.
What are the key properties of 3-dodecylpiperidin-4-ol?
3-dodecylpiperidin-4-ol has a molecular weight of 269.47 g/mol, XLogP of 4.27, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-dodecylpiperidin-4-ol is sourced from PubChem (CID 114451785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).