3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine

C12H15NO2 — CID 84673192

IUPAC3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine
SMILESc1cc2c(cc1OC1CCNC1)OCC2
InChIInChI=1S/C12H15NO2/c1-2-10(15-11-3-5-13-8-11)7-12-9(1)4-6-14-12/h1-2,7,11,13H,3-6,8H2
InChIKeyDPFPVSQKIWIEJR-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.36
Rot. Bonds2

About 3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine

3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine (PubChem CID 84673192) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is 3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine.

Molecular Properties

Compound Name3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine
PubChem CID84673192
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine
SMILESc1cc2c(cc1OC1CCNC1)OCC2
InChIInChI=1S/C12H15NO2/c1-2-10(15-11-3-5-13-8-11)7-12-9(1)4-6-14-12/h1-2,7,11,13H,3-6,8H2
InChIKeyDPFPVSQKIWIEJR-UHFFFAOYSA-N
XLogP1.36
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine?
The IUPAC name of 3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine (CID 84673192) is 3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine.
What is the SMILES notation for 3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine?
The canonical SMILES for 3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine is c1cc2c(cc1OC1CCNC1)OCC2.
What is the InChIKey of 3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine?
The InChIKey is DPFPVSQKIWIEJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-2-10(15-11-3-5-13-8-11)7-12-9(1)4-6-14-12/h1-2,7,11,13H,3-6,8H2.
What are the key properties of 3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine?
3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine has a molecular weight of 205.26 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydro-1-benzofuran-6-yloxy)pyrrolidine is sourced from PubChem (CID 84673192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).