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

C11H15NO — CID 130623728

IUPAC(2R)-2-(4-methoxy-2-methylphenyl)azetidine
SMILESCOc1ccc([C@H]2CCN2)c(C)c1
InChIInChI=1S/C11H15NO/c1-8-7-9(13-2)3-4-10(8)11-5-6-12-11/h3-4,7,11-12H,5-6H2,1-2H3/t11-/m1/s1
InChIKeyYXTLPINTCGJVOB-LLVKDONJSA-N
MW177.25 g/mol
LogP2.04
Rot. Bonds2

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

(2R)-2-(4-methoxy-2-methylphenyl)azetidine (PubChem CID 130623728) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is (2R)-2-(4-methoxy-2-methylphenyl)azetidine.

Molecular Properties

Compound Name(2R)-2-(4-methoxy-2-methylphenyl)azetidine
PubChem CID130623728
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name(2R)-2-(4-methoxy-2-methylphenyl)azetidine
SMILESCOc1ccc([C@H]2CCN2)c(C)c1
InChIInChI=1S/C11H15NO/c1-8-7-9(13-2)3-4-10(8)11-5-6-12-11/h3-4,7,11-12H,5-6H2,1-2H3/t11-/m1/s1
InChIKeyYXTLPINTCGJVOB-LLVKDONJSA-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-methoxy-2-methylphenyl)azepane
CID 26189003
2-(2-bromo-4-methoxyphenyl)azetidine
CID 130534303
(2R)-2-(2-fluoro-4-methoxyphenyl)azetidine;hydrochloride
CID 171197142
2-(2,5-dimethoxyphenyl)azetidine
CID 55295985
(2R)-2-(2-fluoro-5-methoxyphenyl)azetidine;hydrochloride
CID 171197365
(2R)-2-(2-iodo-5-methoxyphenyl)azetidine
CID 130626622
2-[(2S)-azetidin-2-yl]-4-methoxyphenol;hydrochloride
CID 171196735
(4S)-4-(4-methoxy-2-methylphenyl)imidazolidin-2-one
CID 171252808
(2R)-2-(4-chloro-2-methylphenyl)azetidine
CID 130665012
4-(4-methoxy-2-methylphenyl)azepane
CID 83261173
3-[(2S)-azetidin-2-yl]-5-methoxy-1H-indole
CID 171196660
4-methoxy-9-azatricyclo[6.3.1.02,7]dodeca-2(7),3,5-triene
CID 14857735

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-methoxy-2-methylphenyl)azetidine?
The IUPAC name of (2R)-2-(4-methoxy-2-methylphenyl)azetidine (CID 130623728) is (2R)-2-(4-methoxy-2-methylphenyl)azetidine.
What is the SMILES notation for (2R)-2-(4-methoxy-2-methylphenyl)azetidine?
The canonical SMILES for (2R)-2-(4-methoxy-2-methylphenyl)azetidine is COc1ccc([C@H]2CCN2)c(C)c1.
What is the InChIKey of (2R)-2-(4-methoxy-2-methylphenyl)azetidine?
The InChIKey is YXTLPINTCGJVOB-LLVKDONJSA-N. The full InChI is InChI=1S/C11H15NO/c1-8-7-9(13-2)3-4-10(8)11-5-6-12-11/h3-4,7,11-12H,5-6H2,1-2H3/t11-/m1/s1.
What are the key properties of (2R)-2-(4-methoxy-2-methylphenyl)azetidine?
(2R)-2-(4-methoxy-2-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-2-methylphenyl)azetidine is sourced from PubChem (CID 130623728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).