1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol

C15H17FO3 — CID 115836935

IUPAC1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol
SMILESOC(CCC1CCCO1)c1cc2cccc(F)c2o1
InChIInChI=1S/C15H17FO3/c16-12-5-1-3-10-9-14(19-15(10)12)13(17)7-6-11-4-2-8-18-11/h1,3,5,9,11,13,17H,2,4,6-8H2
InChIKeyYDJLCPPNZBSFEE-UHFFFAOYSA-N
MW264.30 g/mol
LogP3.56
Rot. Bonds4

About 1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol

1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol (PubChem CID 115836935) has the molecular formula C15H17FO3 and a molecular weight of 264.30 g/mol. Its IUPAC name is 1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol.

Molecular Properties

Compound Name1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol
PubChem CID115836935
Molecular FormulaC15H17FO3
Molecular Weight264.30 g/mol
Exact Mass264.12
IUPAC Name1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol
SMILESOC(CCC1CCCO1)c1cc2cccc(F)c2o1
InChIInChI=1S/C15H17FO3/c16-12-5-1-3-10-9-14(19-15(10)12)13(17)7-6-11-4-2-8-18-11/h1,3,5,9,11,13,17H,2,4,6-8H2
InChIKeyYDJLCPPNZBSFEE-UHFFFAOYSA-N
XLogP3.56
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.30
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(7-fluoro-1-benzofuran-2-yl)pentan-1-ol
CID 114723732
1-(2,4-difluorophenyl)-3-(oxolan-2-yl)propan-1-ol
CID 65160611
1-(4-chloro-2-fluorophenyl)-3-(oxolan-2-yl)propan-1-ol
CID 65167483
1-(4-chloro-3-fluorophenyl)-3-(oxolan-2-yl)propan-1-ol
CID 65161657
1-(3-chloro-4-fluorophenyl)-3-(oxolan-2-yl)propan-1-ol
CID 65167485
1-(5-bromofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol
CID 65162067
1-(3-bromophenyl)-3-(oxolan-2-yl)propan-1-ol
CID 65161913
1-(2,4-difluoro-5-methylphenyl)-3-(oxolan-2-yl)propan-1-ol
CID 79730679
[(7-fluoro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]hydrazine
CID 105229222
2-(1,3-dioxolan-2-yl)-1-(7-fluoro-1-benzofuran-2-yl)ethanamine
CID 103544181
1-(2-chloro-5-fluorophenyl)-3-(oxolan-2-yl)propan-1-ol
CID 105397716
1-(2,3-difluoro-4-methylphenyl)-3-(oxolan-2-yl)propan-1-ol
CID 107516231

Frequently Asked Questions

What is the IUPAC name of 1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol?
The IUPAC name of 1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol (CID 115836935) is 1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol.
What is the SMILES notation for 1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol?
The canonical SMILES for 1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol is OC(CCC1CCCO1)c1cc2cccc(F)c2o1.
What is the InChIKey of 1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol?
The InChIKey is YDJLCPPNZBSFEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FO3/c16-12-5-1-3-10-9-14(19-15(10)12)13(17)7-6-11-4-2-8-18-11/h1,3,5,9,11,13,17H,2,4,6-8H2.
What are the key properties of 1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol?
1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol has a molecular weight of 264.30 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol is sourced from PubChem (CID 115836935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).