(2R)-2-(4-methoxy-3-methylphenyl)azetidine

C11H15NO — CID 130665442

IUPAC(2R)-2-(4-methoxy-3-methylphenyl)azetidine
SMILESCOc1ccc([C@H]2CCN2)cc1C
InChIInChI=1S/C11H15NO/c1-8-7-9(10-5-6-12-10)3-4-11(8)13-2/h3-4,7,10,12H,5-6H2,1-2H3/t10-/m1/s1
InChIKeyPEFZEHKWBYQCJH-SNVBAGLBSA-N
MW177.25 g/mol
LogP2.04
Rot. Bonds2

About (2R)-2-(4-methoxy-3-methylphenyl)azetidine

(2R)-2-(4-methoxy-3-methylphenyl)azetidine (PubChem CID 130665442) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is (2R)-2-(4-methoxy-3-methylphenyl)azetidine.

Molecular Properties

Compound Name(2R)-2-(4-methoxy-3-methylphenyl)azetidine
PubChem CID130665442
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name(2R)-2-(4-methoxy-3-methylphenyl)azetidine
SMILESCOc1ccc([C@H]2CCN2)cc1C
InChIInChI=1S/C11H15NO/c1-8-7-9(10-5-6-12-10)3-4-11(8)13-2/h3-4,7,10,12H,5-6H2,1-2H3/t10-/m1/s1
InChIKeyPEFZEHKWBYQCJH-SNVBAGLBSA-N
XLogP2.04
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(4-chloro-3-methoxyphenyl)azetidine
CID 55270648
[4-[(2R)-azetidin-2-yl]-2-methoxyphenyl] acetate
CID 171197397
(2S)-2-(4-methoxy-3,5-dimethylphenyl)azetidine;hydrochloride
CID 171196939
2-[3-methoxy-4-(trifluoromethyl)phenyl]azetidine
CID 130043562
2-(4-methoxy-3-methylphenyl)-5-methyl-1,3-diazinane
CID 160572472
2-(4-methoxy-3-methylphenyl)-7-methyl-2,3-dihydro-1H-indole
CID 5224986
4-(azetidin-2-yl)-2-methylbenzonitrile
CID 55282910
(2S)-2-(3,4-dimethoxyphenyl)piperidine;hydrochloride
CID 171194815
2-(4-methoxy-3-propan-2-ylphenyl)pyrrolidine
CID 82158685
(2S)-2-(4-methoxyphenyl)azetidine
CID 55278634
2-(4-methoxy-3-methylphenyl)-7-propan-2-yl-2,3-dihydro-1H-indole
CID 3403694
(2R)-2-(3-fluoro-4-methylphenyl)azetidine
CID 130737796

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-methoxy-3-methylphenyl)azetidine?
The IUPAC name of (2R)-2-(4-methoxy-3-methylphenyl)azetidine (CID 130665442) is (2R)-2-(4-methoxy-3-methylphenyl)azetidine.
What is the SMILES notation for (2R)-2-(4-methoxy-3-methylphenyl)azetidine?
The canonical SMILES for (2R)-2-(4-methoxy-3-methylphenyl)azetidine is COc1ccc([C@H]2CCN2)cc1C.
What is the InChIKey of (2R)-2-(4-methoxy-3-methylphenyl)azetidine?
The InChIKey is PEFZEHKWBYQCJH-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H15NO/c1-8-7-9(10-5-6-12-10)3-4-11(8)13-2/h3-4,7,10,12H,5-6H2,1-2H3/t10-/m1/s1.
What are the key properties of (2R)-2-(4-methoxy-3-methylphenyl)azetidine?
(2R)-2-(4-methoxy-3-methylphenyl)azetidine has a molecular weight of 177.25 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-methoxy-3-methylphenyl)azetidine is sourced from PubChem (CID 130665442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).