(2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine

C11H13NO — CID 130680225

IUPAC(2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine
SMILESc1cc2c(c([C@H]3CCN3)c1)OCC2
InChIInChI=1S/C11H13NO/c1-2-8-5-7-13-11(8)9(3-1)10-4-6-12-10/h1-3,10,12H,4-7H2/t10-/m1/s1
InChIKeyFUDHRWKJHOTUNY-SNVBAGLBSA-N
MW175.23 g/mol
LogP1.66
Rot. Bonds1

About (2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine

(2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine (PubChem CID 130680225) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is (2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine.

Molecular Properties

Compound Name(2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine
PubChem CID130680225
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name(2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine
SMILESc1cc2c(c([C@H]3CCN3)c1)OCC2
InChIInChI=1S/C11H13NO/c1-2-8-5-7-13-11(8)9(3-1)10-4-6-12-10/h1-3,10,12H,4-7H2/t10-/m1/s1
InChIKeyFUDHRWKJHOTUNY-SNVBAGLBSA-N
XLogP1.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dihydro-1-benzofuran-7-yl)-4-methylpiperidine
CID 114746819
3-(2,3-dihydro-1-benzofuran-7-yl)pyrrolidine
CID 82602979
(2R)-2-(2,3-dihydro-1,4-benzodioxin-5-yl)azetidine;hydrochloride
CID 171197468
(2S)-2-(5-fluoro-2,3-dihydro-1-benzofuran-7-yl)azetidine
CID 130965092
(2S)-2-(4-fluoro-2,3-dihydro-1-benzofuran-7-yl)azetidine
CID 130639912
2-(2,3-dihydro-1-benzofuran-7-yl)-6-(trifluoromethyl)piperidine
CID 106781651
7-(2-bromocycloheptyl)-2,3-dihydro-1-benzofuran
CID 114746748
(2R)-2-(2,3-dihydro-1,4-benzodioxin-5-yl)pyrrolidine
CID 51716217
(2R)-2-(3,4-dihydro-2H-chromen-5-yl)azetidine
CID 131172256
N-[[2-(2,3-dihydro-1-benzofuran-7-yl)cyclohexyl]methyl]cyclopropanamine
CID 114747628
3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine
CID 106781652
3-(2,3-dihydro-1-benzofuran-7-yl)-N,2-dimethylcyclopentan-1-amine
CID 114746981

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine?
The IUPAC name of (2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine (CID 130680225) is (2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine.
What is the SMILES notation for (2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine?
The canonical SMILES for (2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine is c1cc2c(c([C@H]3CCN3)c1)OCC2.
What is the InChIKey of (2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine?
The InChIKey is FUDHRWKJHOTUNY-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H13NO/c1-2-8-5-7-13-11(8)9(3-1)10-4-6-12-10/h1-3,10,12H,4-7H2/t10-/m1/s1.
What are the key properties of (2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine?
(2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine has a molecular weight of 175.23 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine is sourced from PubChem (CID 130680225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).