[3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol

C10H10FNO2 — CID 91595047

IUPAC[3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol
SMILESOCC1C=C(c2ccc(F)cc2)NO1
InChIInChI=1S/C10H10FNO2/c11-8-3-1-7(2-4-8)10-5-9(6-13)14-12-10/h1-5,9,12-13H,6H2
InChIKeyLYYSYXBZPNQXLN-UHFFFAOYSA-N
MW195.19 g/mol
LogP1.06
Rot. Bonds2

About [3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol

[3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol (PubChem CID 91595047) has the molecular formula C10H10FNO2 and a molecular weight of 195.19 g/mol. Its IUPAC name is [3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol.

Molecular Properties

Compound Name[3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol
PubChem CID91595047
Molecular FormulaC10H10FNO2
Molecular Weight195.19 g/mol
Exact Mass195.07
IUPAC Name[3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol
SMILESOCC1C=C(c2ccc(F)cc2)NO1
InChIInChI=1S/C10H10FNO2/c11-8-3-1-7(2-4-8)10-5-9(6-13)14-12-10/h1-5,9,12-13H,6H2
InChIKeyLYYSYXBZPNQXLN-UHFFFAOYSA-N
XLogP1.06
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.19
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-fluorophenyl)-5-(trifluoromethyl)-2H-1,2-oxazol-5-ol
CID 4079470
3-phenyl-5-(trifluoromethyl)-2H-1,2-oxazol-5-ol
CID 5056306
[3-[(4-fluorophenyl)methyl]-5-(hydroxymethyl)-2H-1,2-oxazol-5-yl]methanol
CID 56635512
3-[4-(Trifluoromethyl)phenyl]-2,5-dihydro-1,2-oxazole-5-carboxylic acid
CID 56974051
3-(2-Fluorophenyl)-2,5-dihydro-1,2-oxazole-5-carboxylic acid
CID 56980972
[3-(4-Fluorophenyl)-4-methyl-2,5-dihydro-1,2-oxazol-5-yl]methanol
CID 56986394
3-(4-Fluorophenyl)-2,5-dihydro-1,2-oxazole-5-carboxylic acid
CID 57054153
[3-(4-Fluorophenyl)-5-methyl-2,5-dihydro-1,2-oxazol-4-yl]methanol
CID 57113488
3-[3-(Trifluoromethyl)phenyl]-2,5-dihydro-1,2-oxazole-5-carboxylic acid
CID 57217620
3-(3-Fluorophenyl)-2,5-dihydro-1,2-oxazole-5-carboxylic acid
CID 57260376
3-(3-fluorophenyl)-5-(trifluoromethyl)-2H-1,2-oxazol-5-ol
CID 90726686
[3-(3-Fluoro-4-iodophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol
CID 91060512

Frequently Asked Questions

What is the IUPAC name of [3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol?
The IUPAC name of [3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol (CID 91595047) is [3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol.
What is the SMILES notation for [3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol?
The canonical SMILES for [3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol is OCC1C=C(c2ccc(F)cc2)NO1.
What is the InChIKey of [3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol?
The InChIKey is LYYSYXBZPNQXLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO2/c11-8-3-1-7(2-4-8)10-5-9(6-13)14-12-10/h1-5,9,12-13H,6H2.
What are the key properties of [3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol?
[3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol has a molecular weight of 195.19 g/mol, XLogP of 1.06, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methanol is sourced from PubChem (CID 91595047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).