3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol

C8H17NO2 — CID 142595176

IUPAC3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol
SMILESCOC1CN(CCCO)[C@@H]1C
InChIInChI=1S/C8H17NO2/c1-7-8(11-2)6-9(7)4-3-5-10/h7-8,10H,3-6H2,1-2H3/t7-,8?/m1/s1
InChIKeyICLOHYZVHJULQU-GVHYBUMESA-N
MW159.23 g/mol
LogP0.09
Rot. Bonds4

About 3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol

3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol (PubChem CID 142595176) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is 3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol.

Molecular Properties

Compound Name3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol
PubChem CID142595176
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol
SMILESCOC1CN(CCCO)[C@@H]1C
InChIInChI=1S/C8H17NO2/c1-7-8(11-2)6-9(7)4-3-5-10/h7-8,10H,3-6H2,1-2H3/t7-,8?/m1/s1
InChIKeyICLOHYZVHJULQU-GVHYBUMESA-N
XLogP0.09
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol?
The IUPAC name of 3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol (CID 142595176) is 3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol.
What is the SMILES notation for 3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol?
The canonical SMILES for 3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol is COC1CN(CCCO)[C@@H]1C.
What is the InChIKey of 3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol?
The InChIKey is ICLOHYZVHJULQU-GVHYBUMESA-N. The full InChI is InChI=1S/C8H17NO2/c1-7-8(11-2)6-9(7)4-3-5-10/h7-8,10H,3-6H2,1-2H3/t7-,8?/m1/s1.
What are the key properties of 3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol?
3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol has a molecular weight of 159.23 g/mol, XLogP of 0.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2R)-3-methoxy-2-methylazetidin-1-yl]propan-1-ol is sourced from PubChem (CID 142595176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).