(2R)-2-(2,3-dimethylphenyl)azetidine

C11H15N — CID 130714481

IUPAC(2R)-2-(2,3-dimethylphenyl)azetidine
SMILESCc1cccc([C@H]2CCN2)c1C
InChIInChI=1S/C11H15N/c1-8-4-3-5-10(9(8)2)11-6-7-12-11/h3-5,11-12H,6-7H2,1-2H3/t11-/m1/s1
InChIKeyCSLGALAUTYFBAG-LLVKDONJSA-N
MW161.25 g/mol
LogP2.34
Rot. Bonds1

About (2R)-2-(2,3-dimethylphenyl)azetidine

(2R)-2-(2,3-dimethylphenyl)azetidine (PubChem CID 130714481) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is (2R)-2-(2,3-dimethylphenyl)azetidine.

Molecular Properties

Compound Name(2R)-2-(2,3-dimethylphenyl)azetidine
PubChem CID130714481
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name(2R)-2-(2,3-dimethylphenyl)azetidine
SMILESCc1cccc([C@H]2CCN2)c1C
InChIInChI=1S/C11H15N/c1-8-4-3-5-10(9(8)2)11-6-7-12-11/h3-5,11-12H,6-7H2,1-2H3/t11-/m1/s1
InChIKeyCSLGALAUTYFBAG-LLVKDONJSA-N
XLogP2.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,3-dimethylphenyl)azetidine?
The IUPAC name of (2R)-2-(2,3-dimethylphenyl)azetidine (CID 130714481) is (2R)-2-(2,3-dimethylphenyl)azetidine.
What is the SMILES notation for (2R)-2-(2,3-dimethylphenyl)azetidine?
The canonical SMILES for (2R)-2-(2,3-dimethylphenyl)azetidine is Cc1cccc([C@H]2CCN2)c1C.
What is the InChIKey of (2R)-2-(2,3-dimethylphenyl)azetidine?
The InChIKey is CSLGALAUTYFBAG-LLVKDONJSA-N. The full InChI is InChI=1S/C11H15N/c1-8-4-3-5-10(9(8)2)11-6-7-12-11/h3-5,11-12H,6-7H2,1-2H3/t11-/m1/s1.
What are the key properties of (2R)-2-(2,3-dimethylphenyl)azetidine?
(2R)-2-(2,3-dimethylphenyl)azetidine has a molecular weight of 161.25 g/mol, XLogP of 2.34, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,3-dimethylphenyl)azetidine is sourced from PubChem (CID 130714481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).