2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole

C16H12FNO — CID 102468704

IUPAC2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole
SMILESCc1ccc(-c2coc(-c3ccc(F)cc3)n2)cc1
InChIInChI=1S/C16H12FNO/c1-11-2-4-12(5-3-11)15-10-19-16(18-15)13-6-8-14(17)9-7-13/h2-10H,1H3
InChIKeyFECCJJQOGYXHGT-UHFFFAOYSA-N
MW253.28 g/mol
LogP4.46
Rot. Bonds2

About 2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole

2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole (PubChem CID 102468704) has the molecular formula C16H12FNO and a molecular weight of 253.28 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole.

Molecular Properties

Compound Name2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole
PubChem CID102468704
Molecular FormulaC16H12FNO
Molecular Weight253.28 g/mol
Exact Mass253.09
IUPAC Name2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole
SMILESCc1ccc(-c2coc(-c3ccc(F)cc3)n2)cc1
InChIInChI=1S/C16H12FNO/c1-11-2-4-12(5-3-11)15-10-19-16(18-15)13-6-8-14(17)9-7-13/h2-10H,1H3
InChIKeyFECCJJQOGYXHGT-UHFFFAOYSA-N
XLogP4.46
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.28
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-bis(4-fluorophenyl)-1,3-oxazole
CID 21176471
1-(4-fluorophenyl)-3-[4-[4-(4-methylphenyl)-1,3-oxazol-2-yl]phenyl]urea
CID 50835548
methyl 4-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]benzoate
CID 58119372
2-(4-fluorophenyl)-4-(2-methylsulfonylpyrimidin-5-yl)-1,3-oxazole
CID 90223933
3-[4-(4-methylphenyl)-1,3-oxazol-2-yl]aniline
CID 20971452
2-(4-fluorophenyl)-4-propan-2-yl-1,3-oxazole
CID 146379712
2-chloro-4-(4-methylphenyl)-1,3-oxazole
CID 21408388
2-(4-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide
CID 50835518
4-methyl-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]benzamide
CID 50835495
1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]-N-methylmethanamine
CID 60726482
2-(4-chlorophenyl)-4-phenyl-1,3-oxazole
CID 15358896
2-(4-fluorophenyl)-4-(2-isocyanopropan-2-yl)-1,3-oxazole
CID 123356610

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole?
The IUPAC name of 2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole (CID 102468704) is 2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole.
What is the SMILES notation for 2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole?
The canonical SMILES for 2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole is Cc1ccc(-c2coc(-c3ccc(F)cc3)n2)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole?
The InChIKey is FECCJJQOGYXHGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FNO/c1-11-2-4-12(5-3-11)15-10-19-16(18-15)13-6-8-14(17)9-7-13/h2-10H,1H3.
What are the key properties of 2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole?
2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole has a molecular weight of 253.28 g/mol, XLogP of 4.46, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-oxazole is sourced from PubChem (CID 102468704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).