(2-fluorophenyl)-(oxolan-3-yl)methanol

C11H13FO2 — CID 63565123

IUPAC(2-fluorophenyl)-(oxolan-3-yl)methanol
SMILESOC(c1ccccc1F)C1CCOC1
InChIInChI=1S/C11H13FO2/c12-10-4-2-1-3-9(10)11(13)8-5-6-14-7-8/h1-4,8,11,13H,5-7H2
InChIKeyOJJLGDNPVSRZSI-UHFFFAOYSA-N
MW196.22 g/mol
LogP1.90
Rot. Bonds2

About (2-fluorophenyl)-(oxolan-3-yl)methanol

(2-fluorophenyl)-(oxolan-3-yl)methanol (PubChem CID 63565123) has the molecular formula C11H13FO2 and a molecular weight of 196.22 g/mol. Its IUPAC name is (2-fluorophenyl)-(oxolan-3-yl)methanol.

Molecular Properties

Compound Name(2-fluorophenyl)-(oxolan-3-yl)methanol
PubChem CID63565123
Molecular FormulaC11H13FO2
Molecular Weight196.22 g/mol
Exact Mass196.09
IUPAC Name(2-fluorophenyl)-(oxolan-3-yl)methanol
SMILESOC(c1ccccc1F)C1CCOC1
InChIInChI=1S/C11H13FO2/c12-10-4-2-1-3-9(10)11(13)8-5-6-14-7-8/h1-4,8,11,13H,5-7H2
InChIKeyOJJLGDNPVSRZSI-UHFFFAOYSA-N
XLogP1.90
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.22
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl)-(oxolan-3-yl)methanol?
The IUPAC name of (2-fluorophenyl)-(oxolan-3-yl)methanol (CID 63565123) is (2-fluorophenyl)-(oxolan-3-yl)methanol.
What is the SMILES notation for (2-fluorophenyl)-(oxolan-3-yl)methanol?
The canonical SMILES for (2-fluorophenyl)-(oxolan-3-yl)methanol is OC(c1ccccc1F)C1CCOC1.
What is the InChIKey of (2-fluorophenyl)-(oxolan-3-yl)methanol?
The InChIKey is OJJLGDNPVSRZSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FO2/c12-10-4-2-1-3-9(10)11(13)8-5-6-14-7-8/h1-4,8,11,13H,5-7H2.
What are the key properties of (2-fluorophenyl)-(oxolan-3-yl)methanol?
(2-fluorophenyl)-(oxolan-3-yl)methanol has a molecular weight of 196.22 g/mol, XLogP of 1.90, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)-(oxolan-3-yl)methanol is sourced from PubChem (CID 63565123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).