2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol

C10H17NO — CID 143254174

IUPAC2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol
SMILESC=C=CN1CCCCC1CCO
InChIInChI=1S/C10H17NO/c1-2-7-11-8-4-3-5-10(11)6-9-12/h7,10,12H,1,3-6,8-9H2
InChIKeyDMONZHFNWAUGSY-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.52
Rot. Bonds3

About 2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol

2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol (PubChem CID 143254174) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol.

Molecular Properties

Compound Name2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol
PubChem CID143254174
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol
SMILESC=C=CN1CCCCC1CCO
InChIInChI=1S/C10H17NO/c1-2-7-11-8-4-3-5-10(11)6-9-12/h7,10,12H,1,3-6,8-9H2
InChIKeyDMONZHFNWAUGSY-UHFFFAOYSA-N
XLogP1.52
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol?
The IUPAC name of 2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol (CID 143254174) is 2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol.
What is the SMILES notation for 2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol?
The canonical SMILES for 2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol is C=C=CN1CCCCC1CCO.
What is the InChIKey of 2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol?
The InChIKey is DMONZHFNWAUGSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-2-7-11-8-4-3-5-10(11)6-9-12/h7,10,12H,1,3-6,8-9H2.
What are the key properties of 2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol?
2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol has a molecular weight of 167.25 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-propa-1,2-dienylpiperidin-2-yl)ethanol is sourced from PubChem (CID 143254174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).