1-(azetidin-2-yl)-2-methoxyethanol

C6H13NO2 — CID 115007059

IUPAC1-(azetidin-2-yl)-2-methoxyethanol
SMILESCOCC(O)C1CCN1
InChIInChI=1S/C6H13NO2/c1-9-4-6(8)5-2-3-7-5/h5-8H,2-4H2,1H3
InChIKeyCDTDFXGHADAKDV-UHFFFAOYSA-N
MW131.18 g/mol
LogP-0.64
Rot. Bonds3

About 1-(azetidin-2-yl)-2-methoxyethanol

1-(azetidin-2-yl)-2-methoxyethanol (PubChem CID 115007059) has the molecular formula C6H13NO2 and a molecular weight of 131.18 g/mol. Its IUPAC name is 1-(azetidin-2-yl)-2-methoxyethanol.

Molecular Properties

Compound Name1-(azetidin-2-yl)-2-methoxyethanol
PubChem CID115007059
Molecular FormulaC6H13NO2
Molecular Weight131.18 g/mol
Exact Mass131.09
IUPAC Name1-(azetidin-2-yl)-2-methoxyethanol
SMILESCOCC(O)C1CCN1
InChIInChI=1S/C6H13NO2/c1-9-4-6(8)5-2-3-7-5/h5-8H,2-4H2,1H3
InChIKeyCDTDFXGHADAKDV-UHFFFAOYSA-N
XLogP-0.64
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-[(2R, 3S)-3-Hydroxy-1-azetidinyl]-1, 2-ethanediol
CID 56651209
1-(Azetidin-2-yl)ethan-1-ol
CID 23496510
(1S)-1-[(2S,3R)-3-hydroxyazetidin-2-yl]ethane-1,2-diol
CID 56651208
1-(Azetidin-2-yl)ethane-1,2-diol
CID 67183508
2-(2-Hydroxyethyl)azetidin-3-ol
CID 68263910
1-(3-Hydroxyazetidin-2-yl)ethane-1,2-diol
CID 68263995
(3R)-2-[(2R)-1-hydroxy-2-(methylamino)propyl]oxetan-3-ol
CID 70318248
(2R,3S,5S)-2-methoxy-5-methylpyrrolidin-3-ol
CID 132193227
(R)-1-((S)-Azetidin-2-yl)ethan-1-ol
CID 148686602
(1R)-1-[(3R)-3-methylazetidin-2-yl]ethane-1,2-diol
CID 163689253
1-((S)-Azetidin-2-yl)ethan-1-ol
CID 168446213
(1R)-1-(azetidin-2-yl)ethanol
CID 169740342

Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-2-yl)-2-methoxyethanol?
The IUPAC name of 1-(azetidin-2-yl)-2-methoxyethanol (CID 115007059) is 1-(azetidin-2-yl)-2-methoxyethanol.
What is the SMILES notation for 1-(azetidin-2-yl)-2-methoxyethanol?
The canonical SMILES for 1-(azetidin-2-yl)-2-methoxyethanol is COCC(O)C1CCN1.
What is the InChIKey of 1-(azetidin-2-yl)-2-methoxyethanol?
The InChIKey is CDTDFXGHADAKDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2/c1-9-4-6(8)5-2-3-7-5/h5-8H,2-4H2,1H3.
What are the key properties of 1-(azetidin-2-yl)-2-methoxyethanol?
1-(azetidin-2-yl)-2-methoxyethanol has a molecular weight of 131.18 g/mol, XLogP of -0.64, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-2-yl)-2-methoxyethanol is sourced from PubChem (CID 115007059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).