3-piperidin-1-ylprop-1-en-1-ol

C8H15NO — CID 66821435

IUPAC3-piperidin-1-ylprop-1-en-1-ol
SMILESOC=CCN1CCCCC1
InChIInChI=1S/C8H15NO/c10-8-4-7-9-5-2-1-3-6-9/h4,8,10H,1-3,5-7H2
InChIKeyQQXFGBLISWCHIV-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.54
Rot. Bonds2

About 3-piperidin-1-ylprop-1-en-1-ol

3-piperidin-1-ylprop-1-en-1-ol (PubChem CID 66821435) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 3-piperidin-1-ylprop-1-en-1-ol.

Molecular Properties

Compound Name3-piperidin-1-ylprop-1-en-1-ol
PubChem CID66821435
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name3-piperidin-1-ylprop-1-en-1-ol
SMILESOC=CCN1CCCCC1
InChIInChI=1S/C8H15NO/c10-8-4-7-9-5-2-1-3-6-9/h4,8,10H,1-3,5-7H2
InChIKeyQQXFGBLISWCHIV-UHFFFAOYSA-N
XLogP1.54
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-piperidin-1-ylprop-1-en-1-ol?
The IUPAC name of 3-piperidin-1-ylprop-1-en-1-ol (CID 66821435) is 3-piperidin-1-ylprop-1-en-1-ol.
What is the SMILES notation for 3-piperidin-1-ylprop-1-en-1-ol?
The canonical SMILES for 3-piperidin-1-ylprop-1-en-1-ol is OC=CCN1CCCCC1.
What is the InChIKey of 3-piperidin-1-ylprop-1-en-1-ol?
The InChIKey is QQXFGBLISWCHIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c10-8-4-7-9-5-2-1-3-6-9/h4,8,10H,1-3,5-7H2.
What are the key properties of 3-piperidin-1-ylprop-1-en-1-ol?
3-piperidin-1-ylprop-1-en-1-ol has a molecular weight of 141.21 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-1-ylprop-1-en-1-ol is sourced from PubChem (CID 66821435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).