1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol

C8H15NO2 — CID 126856761

IUPAC1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol
SMILESCC1(O)CN(C2CCC2O)C1
InChIInChI=1S/C8H15NO2/c1-8(11)4-9(5-8)6-2-3-7(6)10/h6-7,10-11H,2-5H2,1H3
InChIKeyOUMPFXJZSWTIRK-UHFFFAOYSA-N
MW157.21 g/mol
LogP-0.42
Rot. Bonds1

About 1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol

1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol (PubChem CID 126856761) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol.

Molecular Properties

Compound Name1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol
PubChem CID126856761
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol
SMILESCC1(O)CN(C2CCC2O)C1
InChIInChI=1S/C8H15NO2/c1-8(11)4-9(5-8)6-2-3-7(6)10/h6-7,10-11H,2-5H2,1H3
InChIKeyOUMPFXJZSWTIRK-UHFFFAOYSA-N
XLogP-0.42
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 5-0.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol?
The IUPAC name of 1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol (CID 126856761) is 1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol.
What is the SMILES notation for 1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol?
The canonical SMILES for 1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol is CC1(O)CN(C2CCC2O)C1.
What is the InChIKey of 1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol?
The InChIKey is OUMPFXJZSWTIRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-8(11)4-9(5-8)6-2-3-7(6)10/h6-7,10-11H,2-5H2,1H3.
What are the key properties of 1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol?
1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol has a molecular weight of 157.21 g/mol, XLogP of -0.42, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxycyclobutyl)-3-methylazetidin-3-ol is sourced from PubChem (CID 126856761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).