(2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol

C15H13FO2 — CID 92935775

IUPAC(2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol
SMILESO[C@@H]1C[C@H](c2ccc(F)cc2)Oc2ccccc21
InChIInChI=1S/C15H13FO2/c16-11-7-5-10(6-8-11)15-9-13(17)12-3-1-2-4-14(12)18-15/h1-8,13,15,17H,9H2/t13-,15-/m1/s1
InChIKeyOWSOKOZURXAIPG-UKRRQHHQSA-N
MW244.27 g/mol
LogP3.38
Rot. Bonds1

About (2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol

(2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol (PubChem CID 92935775) has the molecular formula C15H13FO2 and a molecular weight of 244.27 g/mol. Its IUPAC name is (2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol.

Molecular Properties

Compound Name(2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol
PubChem CID92935775
Molecular FormulaC15H13FO2
Molecular Weight244.27 g/mol
Exact Mass244.09
IUPAC Name(2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol
SMILESO[C@@H]1C[C@H](c2ccc(F)cc2)Oc2ccccc21
InChIInChI=1S/C15H13FO2/c16-11-7-5-10(6-8-11)15-9-13(17)12-3-1-2-4-14(12)18-15/h1-8,13,15,17H,9H2/t13-,15-/m1/s1
InChIKeyOWSOKOZURXAIPG-UKRRQHHQSA-N
XLogP3.38
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.27
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,4R)-2-phenyl-3,4-dihydro-2H-chromen-4-ol
CID 6923720
(4R)-2-[4-(trifluoromethyl)phenyl]-3,4-dihydro-2H-chromen-4-ol
CID 104950149
(4S)-7-fluoro-2-phenyl-3,4-dihydro-2H-chromen-4-ol
CID 104951796
2-(3-fluoro-4-methylphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 114715039
2-(1,3-benzodioxol-5-yl)-3,4-dihydro-2H-chromen-4-ol
CID 72766058
(2S,4S)-2-(1,3-benzodioxol-5-yl)-3,4-dihydro-2H-chromen-4-ol
CID 11277233
(4R)-2-(4-propan-2-yloxyphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 104950213
(4R)-2-(4-ethoxyphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 104950145
2-(3-cyclopropylphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 114715024
2-(4-bromophenyl)-7-fluoro-3,4-dihydro-2H-chromen-4-ol
CID 114715787
2-(3-methylphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 114714953
7-fluoro-2-(2-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol
CID 114715763

Frequently Asked Questions

What is the IUPAC name of (2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol?
The IUPAC name of (2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol (CID 92935775) is (2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol.
What is the SMILES notation for (2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol?
The canonical SMILES for (2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol is O[C@@H]1C[C@H](c2ccc(F)cc2)Oc2ccccc21.
What is the InChIKey of (2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol?
The InChIKey is OWSOKOZURXAIPG-UKRRQHHQSA-N. The full InChI is InChI=1S/C15H13FO2/c16-11-7-5-10(6-8-11)15-9-13(17)12-3-1-2-4-14(12)18-15/h1-8,13,15,17H,9H2/t13-,15-/m1/s1.
What are the key properties of (2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol?
(2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol has a molecular weight of 244.27 g/mol, XLogP of 3.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4R)-2-(4-fluorophenyl)-3,4-dihydro-2H-chromen-4-ol is sourced from PubChem (CID 92935775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).