(4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol

C17H14FNO2 — CID 2805205

IUPAC(4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol
SMILESCc1onc(-c2ccccc2)c1C(O)c1ccc(F)cc1
InChIInChI=1S/C17H14FNO2/c1-11-15(17(20)13-7-9-14(18)10-8-13)16(19-21-11)12-5-3-2-4-6-12/h2-10,17,20H,1H3
InChIKeySOLXIBWMKWDVLK-UHFFFAOYSA-N
MW283.30 g/mol
LogP3.87
Rot. Bonds3

About (4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol

(4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol (PubChem CID 2805205) has the molecular formula C17H14FNO2 and a molecular weight of 283.30 g/mol. Its IUPAC name is (4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol.

Molecular Properties

Compound Name(4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol
PubChem CID2805205
Molecular FormulaC17H14FNO2
Molecular Weight283.30 g/mol
Exact Mass283.10
IUPAC Name(4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol
SMILESCc1onc(-c2ccccc2)c1C(O)c1ccc(F)cc1
InChIInChI=1S/C17H14FNO2/c1-11-15(17(20)13-7-9-14(18)10-8-13)16(19-21-11)12-5-3-2-4-6-12/h2-10,17,20H,1H3
InChIKeySOLXIBWMKWDVLK-UHFFFAOYSA-N
XLogP3.87
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.30
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol?
The IUPAC name of (4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol (CID 2805205) is (4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol.
What is the SMILES notation for (4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol?
The canonical SMILES for (4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol is Cc1onc(-c2ccccc2)c1C(O)c1ccc(F)cc1.
What is the InChIKey of (4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol?
The InChIKey is SOLXIBWMKWDVLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO2/c1-11-15(17(20)13-7-9-14(18)10-8-13)16(19-21-11)12-5-3-2-4-6-12/h2-10,17,20H,1H3.
What are the key properties of (4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol?
(4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol has a molecular weight of 283.30 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol is sourced from PubChem (CID 2805205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).