1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol

C18H20O3 — CID 65445625

IUPAC1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol
SMILESCC(O)c1cccc(OCCc2ccc3c(c2)CCO3)c1
InChIInChI=1S/C18H20O3/c1-13(19)15-3-2-4-17(12-15)20-9-7-14-5-6-18-16(11-14)8-10-21-18/h2-6,11-13,19H,7-10H2,1H3
InChIKeyQOJWQMXDLNITRS-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.30
Rot. Bonds5

About 1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol

1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol (PubChem CID 65445625) has the molecular formula C18H20O3 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol.

Molecular Properties

Compound Name1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol
PubChem CID65445625
Molecular FormulaC18H20O3
Molecular Weight284.36 g/mol
Exact Mass284.14
IUPAC Name1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol
SMILESCC(O)c1cccc(OCCc2ccc3c(c2)CCO3)c1
InChIInChI=1S/C18H20O3/c1-13(19)15-3-2-4-17(12-15)20-9-7-14-5-6-18-16(11-14)8-10-21-18/h2-6,11-13,19H,7-10H2,1H3
InChIKeyQOJWQMXDLNITRS-UHFFFAOYSA-N
XLogP3.30
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[2-(4-bromo-3,5-dimethylphenoxy)ethyl]-2,3-dihydro-1-benzofuran
CID 107723704
2-chloro-4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]aniline
CID 65431769
N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-1-(3-methoxyphenyl)ethanamine
CID 60945047
2,3-dihydro-1-benzofuran-5-yl-(3-propylphenyl)methanol
CID 116542515
2-[4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]acetonitrile
CID 65446556
2-(2,3-dihydro-1-benzofuran-5-yl)-N-(2-phenoxyethyl)ethanamine
CID 65446343
5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine
CID 113296520
5-[2-[2-bromo-6-(bromomethyl)phenoxy]ethyl]-2,3-dihydro-1-benzofuran
CID 65446587
1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-2-methyl-3-[2-(3-methylphenoxy)ethyl]guanidine
CID 111563444
5-[2-(2-chlorophenoxy)ethyl]-2,3-dihydro-1-benzofuran
CID 65441677
2-chloro-4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]benzonitrile
CID 102674746
1-[2-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]-N-methylmethanamine
CID 65429354

Frequently Asked Questions

What is the IUPAC name of 1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol?
The IUPAC name of 1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol (CID 65445625) is 1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol.
What is the SMILES notation for 1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol?
The canonical SMILES for 1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol is CC(O)c1cccc(OCCc2ccc3c(c2)CCO3)c1.
What is the InChIKey of 1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol?
The InChIKey is QOJWQMXDLNITRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O3/c1-13(19)15-3-2-4-17(12-15)20-9-7-14-5-6-18-16(11-14)8-10-21-18/h2-6,11-13,19H,7-10H2,1H3.
What are the key properties of 1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol?
1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol has a molecular weight of 284.36 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol is sourced from PubChem (CID 65445625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).