2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole

C16H14FNO — CID 164510912

IUPAC2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole
SMILESCc1ccc(C2CN=C(c3ccc(F)cc3)O2)cc1
InChIInChI=1S/C16H14FNO/c1-11-2-4-12(5-3-11)15-10-18-16(19-15)13-6-8-14(17)9-7-13/h2-9,15H,10H2,1H3
InChIKeySLOAWQAVWDDPMT-UHFFFAOYSA-N
MW255.29 g/mol
LogP3.65
Rot. Bonds2

About 2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole

2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole (PubChem CID 164510912) has the molecular formula C16H14FNO and a molecular weight of 255.29 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole.

Molecular Properties

Compound Name2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole
PubChem CID164510912
Molecular FormulaC16H14FNO
Molecular Weight255.29 g/mol
Exact Mass255.11
IUPAC Name2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole
SMILESCc1ccc(C2CN=C(c3ccc(F)cc3)O2)cc1
InChIInChI=1S/C16H14FNO/c1-11-2-4-12(5-3-11)15-10-18-16(19-15)13-6-8-14(17)9-7-13/h2-9,15H,10H2,1H3
InChIKeySLOAWQAVWDDPMT-UHFFFAOYSA-N
XLogP3.65
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.29
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Mls002667700
CID 244135
2-(4-Methylphenyl)oxazoline
CID 3770227
2,4-Diphenyl-1,3-oxazoline
CID 10889524
2-(4-Propylphenyl)-4,5-dihydro-1,3-oxazole
CID 12793312
4-(4-Tert-butylphenyl)-2-(2,6-difluorophenyl)-4,5-dihydro-1,3-oxazole
CID 14853220
2-(2,6-Difluorophenyl)-4-(4-octylphenyl)-4,5-dihydro-1,3-oxazole
CID 15007761
2-(2,6-Difluorophenyl)-4-(4-n-decylphenyl)-2-oxazoline
CID 15007772
2-(2,6-Difluorophenyl)-4-(4-ethylphenyl)-4,5-dihydro-1,3-oxazole
CID 76334202
2-[4-(Trifluoromethyl)phenyl]-4,5-dihydro-1,3-oxazole
CID 2725909
2-(4-fluorophenyl)-6-phenyl-5,6-dihydro-4H-1,3-oxazine
CID 9547849
2-(3-Methylphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole
CID 9547842
2-(4-Butylphenyl)-4,5-dihydro-1,3-oxazole
CID 132519396

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole?
The IUPAC name of 2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole (CID 164510912) is 2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole.
What is the SMILES notation for 2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole?
The canonical SMILES for 2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole is Cc1ccc(C2CN=C(c3ccc(F)cc3)O2)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole?
The InChIKey is SLOAWQAVWDDPMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FNO/c1-11-2-4-12(5-3-11)15-10-18-16(19-15)13-6-8-14(17)9-7-13/h2-9,15H,10H2,1H3.
What are the key properties of 2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole?
2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole has a molecular weight of 255.29 g/mol, XLogP of 3.65, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1,3-oxazole is sourced from PubChem (CID 164510912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).