2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol

C15H12FNO2 — CID 173312747

IUPAC2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol
SMILESOc1cc(C2=NC[C@@H](c3ccccc3)O2)ccc1F
InChIInChI=1S/C15H12FNO2/c16-12-7-6-11(8-13(12)18)15-17-9-14(19-15)10-4-2-1-3-5-10/h1-8,14,18H,9H2/t14-/m0/s1
InChIKeyAALNPOVBNQZEGU-AWEZNQCLSA-N
MW257.26 g/mol
LogP3.05
Rot. Bonds2

About 2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol

2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol (PubChem CID 173312747) has the molecular formula C15H12FNO2 and a molecular weight of 257.26 g/mol. Its IUPAC name is 2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol.

Molecular Properties

Compound Name2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol
PubChem CID173312747
Molecular FormulaC15H12FNO2
Molecular Weight257.26 g/mol
Exact Mass257.09
IUPAC Name2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol
SMILESOc1cc(C2=NC[C@@H](c3ccccc3)O2)ccc1F
InChIInChI=1S/C15H12FNO2/c16-12-7-6-11(8-13(12)18)15-17-9-14(19-15)10-4-2-1-3-5-10/h1-8,14,18H,9H2/t14-/m0/s1
InChIKeyAALNPOVBNQZEGU-AWEZNQCLSA-N
XLogP3.05
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.26
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol?
The IUPAC name of 2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol (CID 173312747) is 2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol.
What is the SMILES notation for 2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol?
The canonical SMILES for 2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol is Oc1cc(C2=NC[C@@H](c3ccccc3)O2)ccc1F.
What is the InChIKey of 2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol?
The InChIKey is AALNPOVBNQZEGU-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H12FNO2/c16-12-7-6-11(8-13(12)18)15-17-9-14(19-15)10-4-2-1-3-5-10/h1-8,14,18H,9H2/t14-/m0/s1.
What are the key properties of 2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol?
2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol has a molecular weight of 257.26 g/mol, XLogP of 3.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-[(5R)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenol is sourced from PubChem (CID 173312747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).