2-(3-methylpiperidin-4-yl)ethanol

C8H17NO — CID 13419581

IUPAC2-(3-methylpiperidin-4-yl)ethanol
SMILESCC1CNCCC1CCO
InChIInChI=1S/C8H17NO/c1-7-6-9-4-2-8(7)3-5-10/h7-10H,2-6H2,1H3
InChIKeyPYVUXEULPSUTEE-UHFFFAOYSA-N
MW143.23 g/mol
LogP0.61
Rot. Bonds2

About 2-(3-methylpiperidin-4-yl)ethanol

2-(3-methylpiperidin-4-yl)ethanol (PubChem CID 13419581) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 2-(3-methylpiperidin-4-yl)ethanol.

Molecular Properties

Compound Name2-(3-methylpiperidin-4-yl)ethanol
PubChem CID13419581
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name2-(3-methylpiperidin-4-yl)ethanol
SMILESCC1CNCCC1CCO
InChIInChI=1S/C8H17NO/c1-7-6-9-4-2-8(7)3-5-10/h7-10H,2-6H2,1H3
InChIKeyPYVUXEULPSUTEE-UHFFFAOYSA-N
XLogP0.61
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methylpiperidin-4-yl)ethanol?
The IUPAC name of 2-(3-methylpiperidin-4-yl)ethanol (CID 13419581) is 2-(3-methylpiperidin-4-yl)ethanol.
What is the SMILES notation for 2-(3-methylpiperidin-4-yl)ethanol?
The canonical SMILES for 2-(3-methylpiperidin-4-yl)ethanol is CC1CNCCC1CCO.
What is the InChIKey of 2-(3-methylpiperidin-4-yl)ethanol?
The InChIKey is PYVUXEULPSUTEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-7-6-9-4-2-8(7)3-5-10/h7-10H,2-6H2,1H3.
What are the key properties of 2-(3-methylpiperidin-4-yl)ethanol?
2-(3-methylpiperidin-4-yl)ethanol has a molecular weight of 143.23 g/mol, XLogP of 0.61, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylpiperidin-4-yl)ethanol is sourced from PubChem (CID 13419581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).