2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol

C11H21NO — CID 62356828

IUPAC2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol
SMILESC=C(C)CN1CCCC(CCO)C1
InChIInChI=1S/C11H21NO/c1-10(2)8-12-6-3-4-11(9-12)5-7-13/h11,13H,1,3-9H2,2H3
InChIKeyPZAJGQPWRBTSLA-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.66
Rot. Bonds4

About 2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol

2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol (PubChem CID 62356828) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol
PubChem CID62356828
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol
SMILESC=C(C)CN1CCCC(CCO)C1
InChIInChI=1S/C11H21NO/c1-10(2)8-12-6-3-4-11(9-12)5-7-13/h11,13H,1,3-9H2,2H3
InChIKeyPZAJGQPWRBTSLA-UHFFFAOYSA-N
XLogP1.66
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(1-Methylpiperidin-3-yl)ethan-1-ol
CID 21702803
3-(1-Methylpiperidin-4-yl)propan-1-ol
CID 15540677
2-Fluoro-2-(1-methylpiperidin-3-yl)ethanol
CID 105431686
2-(1-Ethylpiperidin-3-yl)-2-fluoroethanol
CID 105436243
2-(1-Propan-2-ylpiperidin-3-yl)ethanol
CID 19097405
2-(1-Ethylpiperidin-3-yl)ethanol
CID 21702811
2-(1-Propylpiperidin-3-yl)ethanol
CID 22987971
3-(1-Butylpiperidin-4-yl)propan-1-ol
CID 23179732
2-(1-Butylpiperidin-3-yl)ethanol
CID 54000357
3-(1-Ethyl-4-piperidinyl)-1-propanol
CID 54239091
3-(1-Pentylpiperidin-4-YL)propan-1-OL
CID 54356582
2-[1-(1-Methoxyethyl)piperidin-3-yl]ethanol
CID 57198101

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol?
The IUPAC name of 2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol (CID 62356828) is 2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol.
What is the SMILES notation for 2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol?
The canonical SMILES for 2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol is C=C(C)CN1CCCC(CCO)C1.
What is the InChIKey of 2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol?
The InChIKey is PZAJGQPWRBTSLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-10(2)8-12-6-3-4-11(9-12)5-7-13/h11,13H,1,3-9H2,2H3.
What are the key properties of 2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol?
2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol has a molecular weight of 183.29 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methylprop-2-enyl)piperidin-3-yl]ethanol is sourced from PubChem (CID 62356828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).