3-(2-methylpropoxy)azetidine;hydrochloride

C7H16ClNO — CID 67154547

IUPAC3-(2-methylpropoxy)azetidine;hydrochloride
SMILESCC(C)COC1CNC1.Cl
InChIInChI=1S/C7H15NO.ClH/c1-6(2)5-9-7-3-8-4-7;/h6-8H,3-5H2,1-2H3;1H
InChIKeyVYVVLPMWPWLLKT-UHFFFAOYSA-N
MW165.66 g/mol
LogP1.05
Rot. Bonds3

About 3-(2-methylpropoxy)azetidine;hydrochloride

3-(2-methylpropoxy)azetidine;hydrochloride (PubChem CID 67154547) has the molecular formula C7H16ClNO and a molecular weight of 165.66 g/mol. Its IUPAC name is 3-(2-methylpropoxy)azetidine;hydrochloride.

Molecular Properties

Compound Name3-(2-methylpropoxy)azetidine;hydrochloride
PubChem CID67154547
Molecular FormulaC7H16ClNO
Molecular Weight165.66 g/mol
Exact Mass165.09
IUPAC Name3-(2-methylpropoxy)azetidine;hydrochloride
SMILESCC(C)COC1CNC1.Cl
InChIInChI=1S/C7H15NO.ClH/c1-6(2)5-9-7-3-8-4-7;/h6-8H,3-5H2,1-2H3;1H
InChIKeyVYVVLPMWPWLLKT-UHFFFAOYSA-N
XLogP1.05
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.66
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethoxyazetidine
CID 22507733
3-(6-methylheptoxy)azetidine
CID 165499663
3-(azetidin-3-yloxy)-1,1,1-trifluoropropan-2-ol
CID 106939889
(2R,4S)-2-butyl-4-(2-methylpropoxy)pyrrolidine
CID 99994645
1,3-bis(2-methylpropoxy)cyclohexane
CID 142724775
propan-2-yl 2-(azetidin-3-yloxy)acetate
CID 106939880
3-(cyclobutylmethoxy)azetidine;hydrochloride
CID 75365400
3-[(2-methylcyclopropyl)methoxy]azetidine
CID 165499801
3-pentan-2-yloxyazetidine
CID 102981936
4-[[3-(2-methylpropoxy)pyrrolidin-1-yl]methyl]piperidine;hydrochloride
CID 119932458
5-[2-(2-methylpropoxy)ethoxy]piperidine-3-carboxylic acid
CID 106453624
3-(azetidin-3-yloxy)propanenitrile;hydrochloride
CID 170627171

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpropoxy)azetidine;hydrochloride?
The IUPAC name of 3-(2-methylpropoxy)azetidine;hydrochloride (CID 67154547) is 3-(2-methylpropoxy)azetidine;hydrochloride.
What is the SMILES notation for 3-(2-methylpropoxy)azetidine;hydrochloride?
The canonical SMILES for 3-(2-methylpropoxy)azetidine;hydrochloride is CC(C)COC1CNC1.Cl.
What is the InChIKey of 3-(2-methylpropoxy)azetidine;hydrochloride?
The InChIKey is VYVVLPMWPWLLKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.ClH/c1-6(2)5-9-7-3-8-4-7;/h6-8H,3-5H2,1-2H3;1H.
What are the key properties of 3-(2-methylpropoxy)azetidine;hydrochloride?
3-(2-methylpropoxy)azetidine;hydrochloride has a molecular weight of 165.66 g/mol, XLogP of 1.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpropoxy)azetidine;hydrochloride is sourced from PubChem (CID 67154547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).