3-methoxyazetidine;hydrochloride

C4H10ClNO — CID 22242858

IUPAC3-methoxyazetidine;hydrochloride
SMILESCOC1CNC1.Cl
InChIInChI=1S/C4H9NO.ClH/c1-6-4-2-5-3-4;/h4-5H,2-3H2,1H3;1H
InChIKeyKSXGQRBTBLQJEF-UHFFFAOYSA-N
MW123.58 g/mol
LogP0.03
Rot. Bonds1

About 3-methoxyazetidine;hydrochloride

3-methoxyazetidine;hydrochloride (PubChem CID 22242858) has the molecular formula C4H10ClNO and a molecular weight of 123.58 g/mol. Its IUPAC name is 3-methoxyazetidine;hydrochloride.

Molecular Properties

Compound Name3-methoxyazetidine;hydrochloride
PubChem CID22242858
Molecular FormulaC4H10ClNO
Molecular Weight123.58 g/mol
Exact Mass123.05
IUPAC Name3-methoxyazetidine;hydrochloride
SMILESCOC1CNC1.Cl
InChIInChI=1S/C4H9NO.ClH/c1-6-4-2-5-3-4;/h4-5H,2-3H2,1H3;1H
InChIKeyKSXGQRBTBLQJEF-UHFFFAOYSA-N
XLogP0.03
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.58
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-Methoxyazetidine
CID 13401996
3-Isopropoxy-Azetidine
CID 51358586
3-(2-Methoxyethoxy)azetidine hydrochloride
CID 17817373
3-Ethoxyazetidine hydrochloride
CID 22507732
(2-Methoxypropyl)(methyl)amine hydrochloride
CID 25049826
3-(3-Methoxypropoxy)azetidine hydrochloride
CID 67154482
3-(2-Methylpropoxy)azetidine hydrochloride
CID 67154547
3-(Prop-2-yn-1-yloxy)azetidine hydrochloride
CID 71299285
3-(Tert-butoxy)azetidine hydrochloride
CID 71755657
3-Cyclopropoxyazetidine
CID 72716707
3-(2,2-Difluoroethoxy)azetidine hydrochloride
CID 73994827
3-(Difluoromethoxy)azetidine hydrochloride
CID 75481664

Frequently Asked Questions

What is the IUPAC name of 3-methoxyazetidine;hydrochloride?
The IUPAC name of 3-methoxyazetidine;hydrochloride (CID 22242858) is 3-methoxyazetidine;hydrochloride.
What is the SMILES notation for 3-methoxyazetidine;hydrochloride?
The canonical SMILES for 3-methoxyazetidine;hydrochloride is COC1CNC1.Cl.
What is the InChIKey of 3-methoxyazetidine;hydrochloride?
The InChIKey is KSXGQRBTBLQJEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO.ClH/c1-6-4-2-5-3-4;/h4-5H,2-3H2,1H3;1H.
What are the key properties of 3-methoxyazetidine;hydrochloride?
3-methoxyazetidine;hydrochloride has a molecular weight of 123.58 g/mol, XLogP of 0.03, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxyazetidine;hydrochloride is sourced from PubChem (CID 22242858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).