[1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol

C11H22N2O — CID 123835791

IUPAC[1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol
SMILESOCC1CCN(CCC2CCN2)CC1
InChIInChI=1S/C11H22N2O/c14-9-10-2-6-13(7-3-10)8-4-11-1-5-12-11/h10-12,14H,1-9H2
InChIKeyYOMLPVJYASUTKF-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.44
Rot. Bonds4

About [1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol

[1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol (PubChem CID 123835791) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is [1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol
PubChem CID123835791
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name[1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol
SMILESOCC1CCN(CCC2CCN2)CC1
InChIInChI=1S/C11H22N2O/c14-9-10-2-6-13(7-3-10)8-4-11-1-5-12-11/h10-12,14H,1-9H2
InChIKeyYOMLPVJYASUTKF-UHFFFAOYSA-N
XLogP0.44
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[2-(azetidin-3-yl)ethyl]piperidin-4-yl]methanol
CID 107391013
[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methanol
CID 54080163
6-[4-(hydroxymethyl)piperidin-1-yl]hexan-1-ol
CID 103737785
3-[4-(hydroxymethyl)piperidin-1-yl]propanenitrile
CID 43133161
(1-prop-2-enylpiperidin-4-yl)methanol
CID 60768656
bis[1-(2-pyrrolidin-2-ylethyl)piperidin-4-yl]methanone
CID 174669277
2-[2-[4-(hydroxymethyl)piperidin-1-yl]ethoxy]acetaldehyde
CID 126718825
[1-[2-(diethylamino)ethyl]piperidin-4-yl]methanol
CID 62020074
[1-(2-ethylsulfanylethyl)piperidin-4-yl]methanol
CID 111432876
[1-(3,3-dichloroprop-2-enyl)piperidin-4-yl]methanol
CID 164655973
5-[4-(hydroxymethyl)piperidin-1-yl]pentanenitrile
CID 53418278
3-[2-[4-(hydroxymethyl)piperidin-1-yl]ethyl]imidazolidine-2,4-dione
CID 60966909

Frequently Asked Questions

What is the IUPAC name of [1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol?
The IUPAC name of [1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol (CID 123835791) is [1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol.
What is the SMILES notation for [1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol?
The canonical SMILES for [1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol is OCC1CCN(CCC2CCN2)CC1.
What is the InChIKey of [1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol?
The InChIKey is YOMLPVJYASUTKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c14-9-10-2-6-13(7-3-10)8-4-11-1-5-12-11/h10-12,14H,1-9H2.
What are the key properties of [1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol?
[1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol has a molecular weight of 198.31 g/mol, XLogP of 0.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol is sourced from PubChem (CID 123835791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).