3-(3-methoxy-4-methylphenyl)azetidin-3-ol

C11H15NO2 — CID 130052049

IUPAC3-(3-methoxy-4-methylphenyl)azetidin-3-ol
SMILESCOc1cc(C2(O)CNC2)ccc1C
InChIInChI=1S/C11H15NO2/c1-8-3-4-9(5-10(8)14-2)11(13)6-12-7-11/h3-5,12-13H,6-7H2,1-2H3
InChIKeyADAFOXDLZFAKBT-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.79
Rot. Bonds2

About 3-(3-methoxy-4-methylphenyl)azetidin-3-ol

3-(3-methoxy-4-methylphenyl)azetidin-3-ol (PubChem CID 130052049) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 3-(3-methoxy-4-methylphenyl)azetidin-3-ol.

Molecular Properties

Compound Name3-(3-methoxy-4-methylphenyl)azetidin-3-ol
PubChem CID130052049
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name3-(3-methoxy-4-methylphenyl)azetidin-3-ol
SMILESCOc1cc(C2(O)CNC2)ccc1C
InChIInChI=1S/C11H15NO2/c1-8-3-4-9(5-10(8)14-2)11(13)6-12-7-11/h3-5,12-13H,6-7H2,1-2H3
InChIKeyADAFOXDLZFAKBT-UHFFFAOYSA-N
XLogP0.79
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-1-(3-methoxy-4-methylphenyl)cyclopropan-1-ol
CID 79333625
1-(3-methoxy-4-methylphenyl)cyclopropane-1-carboxylic acid
CID 16770133
2-(3-methoxy-4-methylphenyl)-7-oxaspiro[3.5]nonan-2-amine
CID 65006110
4-(1-butan-2-ylcyclopropyl)-2-methoxy-1-methylbenzene
CID 171099345
1-(3-methoxy-4-methylphenyl)cycloheptan-1-amine
CID 43146596
4-(3-methoxy-4-phenylphenyl)piperidin-4-ol
CID 139901331
2-(3-methoxy-4-methylphenyl)spiro[3.3]heptane-2-carboxylic acid
CID 65009437
1-(3-methoxy-4-methylphenyl)cyclohexane-1-carboxylic acid
CID 16769454
1,4-diazepan-1-yl-[1-(3-methoxy-4-methylphenyl)cyclopentyl]methanone
CID 119415679
[3-(3-methoxy-4-methylphenyl)oxetan-3-yl] acetate
CID 166695311
[2-(3-methoxy-4-methylphenyl)spiro[3.4]octan-2-yl]methanamine
CID 65002969
4-(6-methoxynaphthalen-2-yl)piperidin-4-ol;hydrochloride
CID 142647916

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxy-4-methylphenyl)azetidin-3-ol?
The IUPAC name of 3-(3-methoxy-4-methylphenyl)azetidin-3-ol (CID 130052049) is 3-(3-methoxy-4-methylphenyl)azetidin-3-ol.
What is the SMILES notation for 3-(3-methoxy-4-methylphenyl)azetidin-3-ol?
The canonical SMILES for 3-(3-methoxy-4-methylphenyl)azetidin-3-ol is COc1cc(C2(O)CNC2)ccc1C.
What is the InChIKey of 3-(3-methoxy-4-methylphenyl)azetidin-3-ol?
The InChIKey is ADAFOXDLZFAKBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-8-3-4-9(5-10(8)14-2)11(13)6-12-7-11/h3-5,12-13H,6-7H2,1-2H3.
What are the key properties of 3-(3-methoxy-4-methylphenyl)azetidin-3-ol?
3-(3-methoxy-4-methylphenyl)azetidin-3-ol has a molecular weight of 193.25 g/mol, XLogP of 0.79, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxy-4-methylphenyl)azetidin-3-ol is sourced from PubChem (CID 130052049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).