N-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide

C17H13FN2O2 — CID 17393566

IUPACN-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide
SMILESCc1oc(-c2ccccc2)nc1C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C17H13FN2O2/c1-11-15(16(21)19-14-9-7-13(18)8-10-14)20-17(22-11)12-5-3-2-4-6-12/h2-10H,1H3,(H,19,21)
InChIKeyVWARVTKOQMFFOQ-UHFFFAOYSA-N
MW296.30 g/mol
LogP4.04
Rot. Bonds3

About N-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide

N-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide (PubChem CID 17393566) has the molecular formula C17H13FN2O2 and a molecular weight of 296.30 g/mol. Its IUPAC name is N-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide
PubChem CID17393566
Molecular FormulaC17H13FN2O2
Molecular Weight296.30 g/mol
Exact Mass296.10
IUPAC NameN-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide
SMILESCc1oc(-c2ccccc2)nc1C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C17H13FN2O2/c1-11-15(16(21)19-14-9-7-13(18)8-10-14)20-17(22-11)12-5-3-2-4-6-12/h2-10H,1H3,(H,19,21)
InChIKeyVWARVTKOQMFFOQ-UHFFFAOYSA-N
XLogP4.04
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.30
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-difluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide
CID 26360076
5-methyl-2-phenyl-N-(4-piperidin-1-ylphenyl)-1,3-oxazole-4-carboxamide
CID 26289707
5-methyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-phenyl-1,3-oxazole-4-carboxamide
CID 24560242
5-methyl-N-(1-methylpyrazol-4-yl)-2-phenyl-1,3-oxazole-4-carboxamide
CID 32606809
1-(4-fluorophenyl)-3-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]urea
CID 20955490
5-methyl-2-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3-oxazole-4-carboxamide
CID 17396165
N-(3-chloro-4-methoxyphenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide
CID 26735908
5-methyl-2-phenyl-N-[3-(propan-2-ylcarbamoylamino)phenyl]-1,3-oxazole-4-carboxamide
CID 31888702
N-[3-(4-bromoanilino)-3-oxopropyl]-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide
CID 55951068
5-[4-[(4-fluorobenzoyl)amino]phenyl]-2-phenyl-N-pyridin-2-yl-1,3-oxazole-4-carboxamide
CID 70168521
N-(2-amino-4,5-dichlorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide
CID 90882730
[(2R)-1-(4-fluorophenyl)-1-oxopropan-2-yl] 5-methyl-2-phenyl-1,3-oxazole-4-carboxylate
CID 7727103

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide (CID 17393566) is N-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide is Cc1oc(-c2ccccc2)nc1C(=O)Nc1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide?
The InChIKey is VWARVTKOQMFFOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN2O2/c1-11-15(16(21)19-14-9-7-13(18)8-10-14)20-17(22-11)12-5-3-2-4-6-12/h2-10H,1H3,(H,19,21).
What are the key properties of N-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide?
N-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide has a molecular weight of 296.30 g/mol, XLogP of 4.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 17393566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).