4-cyclopropyl-2-ethyl-1-benzofuran

C13H14O — CID 163372341

IUPAC4-cyclopropyl-2-ethyl-1-benzofuran
SMILESCCc1cc2c(C3CC3)cccc2o1
InChIInChI=1S/C13H14O/c1-2-10-8-12-11(9-6-7-9)4-3-5-13(12)14-10/h3-5,8-9H,2,6-7H2,1H3
InChIKeyYBAGBKFGAHIDGE-UHFFFAOYSA-N
MW186.25 g/mol
LogP3.87
Rot. Bonds2

About 4-cyclopropyl-2-ethyl-1-benzofuran

4-cyclopropyl-2-ethyl-1-benzofuran (PubChem CID 163372341) has the molecular formula C13H14O and a molecular weight of 186.25 g/mol. Its IUPAC name is 4-cyclopropyl-2-ethyl-1-benzofuran.

Molecular Properties

Compound Name4-cyclopropyl-2-ethyl-1-benzofuran
PubChem CID163372341
Molecular FormulaC13H14O
Molecular Weight186.25 g/mol
Exact Mass186.10
IUPAC Name4-cyclopropyl-2-ethyl-1-benzofuran
SMILESCCc1cc2c(C3CC3)cccc2o1
InChIInChI=1S/C13H14O/c1-2-10-8-12-11(9-6-7-9)4-3-5-13(12)14-10/h3-5,8-9H,2,6-7H2,1H3
InChIKeyYBAGBKFGAHIDGE-UHFFFAOYSA-N
XLogP3.87
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-2-ethyl-1-benzofuran?
The IUPAC name of 4-cyclopropyl-2-ethyl-1-benzofuran (CID 163372341) is 4-cyclopropyl-2-ethyl-1-benzofuran.
What is the SMILES notation for 4-cyclopropyl-2-ethyl-1-benzofuran?
The canonical SMILES for 4-cyclopropyl-2-ethyl-1-benzofuran is CCc1cc2c(C3CC3)cccc2o1.
What is the InChIKey of 4-cyclopropyl-2-ethyl-1-benzofuran?
The InChIKey is YBAGBKFGAHIDGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O/c1-2-10-8-12-11(9-6-7-9)4-3-5-13(12)14-10/h3-5,8-9H,2,6-7H2,1H3.
What are the key properties of 4-cyclopropyl-2-ethyl-1-benzofuran?
4-cyclopropyl-2-ethyl-1-benzofuran has a molecular weight of 186.25 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-2-ethyl-1-benzofuran is sourced from PubChem (CID 163372341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).