3-ethyl-3-methoxyazetidine;hydrochloride

C6H14ClNO — CID 66592095

IUPAC3-ethyl-3-methoxyazetidine;hydrochloride
SMILESCCC1(OC)CNC1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-3-6(8-2)4-7-5-6;/h7H,3-5H2,1-2H3;1H
InChIKeyQAYOJFYHLXVXJI-UHFFFAOYSA-N
MW151.64 g/mol
LogP0.81
Rot. Bonds2

About 3-ethyl-3-methoxyazetidine;hydrochloride

3-ethyl-3-methoxyazetidine;hydrochloride (PubChem CID 66592095) has the molecular formula C6H14ClNO and a molecular weight of 151.64 g/mol. Its IUPAC name is 3-ethyl-3-methoxyazetidine;hydrochloride.

Molecular Properties

Compound Name3-ethyl-3-methoxyazetidine;hydrochloride
PubChem CID66592095
Molecular FormulaC6H14ClNO
Molecular Weight151.64 g/mol
Exact Mass151.08
IUPAC Name3-ethyl-3-methoxyazetidine;hydrochloride
SMILESCCC1(OC)CNC1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-3-6(8-2)4-7-5-6;/h7H,3-5H2,1-2H3;1H
InChIKeyQAYOJFYHLXVXJI-UHFFFAOYSA-N
XLogP0.81
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.64
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3-methoxyazetidine;hydrochloride?
The IUPAC name of 3-ethyl-3-methoxyazetidine;hydrochloride (CID 66592095) is 3-ethyl-3-methoxyazetidine;hydrochloride.
What is the SMILES notation for 3-ethyl-3-methoxyazetidine;hydrochloride?
The canonical SMILES for 3-ethyl-3-methoxyazetidine;hydrochloride is CCC1(OC)CNC1.Cl.
What is the InChIKey of 3-ethyl-3-methoxyazetidine;hydrochloride?
The InChIKey is QAYOJFYHLXVXJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.ClH/c1-3-6(8-2)4-7-5-6;/h7H,3-5H2,1-2H3;1H.
What are the key properties of 3-ethyl-3-methoxyazetidine;hydrochloride?
3-ethyl-3-methoxyazetidine;hydrochloride has a molecular weight of 151.64 g/mol, XLogP of 0.81, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3-methoxyazetidine;hydrochloride is sourced from PubChem (CID 66592095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).