N-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide

C11H8FN3O3 — CID 2744430

IUPACN-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide
SMILESO=C(NC(=O)c1ccno1)Nc1ccc(F)cc1
InChIInChI=1S/C11H8FN3O3/c12-7-1-3-8(4-2-7)14-11(17)15-10(16)9-5-6-13-18-9/h1-6H,(H2,14,15,16,17)
InChIKeyOZLOODMBUKCFMZ-UHFFFAOYSA-N
MW249.20 g/mol
LogP1.78
Rot. Bonds2

About N-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide

N-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide (PubChem CID 2744430) has the molecular formula C11H8FN3O3 and a molecular weight of 249.20 g/mol. Its IUPAC name is N-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide
PubChem CID2744430
Molecular FormulaC11H8FN3O3
Molecular Weight249.20 g/mol
Exact Mass249.05
IUPAC NameN-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide
SMILESO=C(NC(=O)c1ccno1)Nc1ccc(F)cc1
InChIInChI=1S/C11H8FN3O3/c12-7-1-3-8(4-2-7)14-11(17)15-10(16)9-5-6-13-18-9/h1-6H,(H2,14,15,16,17)
InChIKeyOZLOODMBUKCFMZ-UHFFFAOYSA-N
XLogP1.78
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.20
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylphenyl)-1,2-oxazole-5-carboxamide
CID 7996638
N-(2-(piperidin-1-yl)phenyl)isoxazole-5-carboxamide
CID 11277266
N-isoxazol-5-yl-N'-phenylurea
CID 2744683
N-(4-chlorophenyl)isoxazole-5-carboxamide
CID 2744445
N-[6-(2-aminoanilino)-6-oxohexyl]-1,2-oxazole-5-carboxamide
CID 45137578
N-(4-fluorophenyl)isoxazole-5-carboxamide
CID 18587294
N-(4-bromophenyl)-1,2-oxazole-5-carboxamide
CID 18587281
N-[5-(2-aminoanilino)-5-oxopentyl]-1,2-oxazole-5-carboxamide
CID 60207654
N-[(2-chlorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide
CID 2744429
N-(4-nitrophenyl)isoxazole-5-carboxamide
CID 18587279
N-(3-(4-phenylpiperazin-1-yl)propyl)isoxazole-5-carboxamide
CID 45561396
N-[4-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxamide
CID 2744444

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide?
The IUPAC name of N-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide (CID 2744430) is N-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide is O=C(NC(=O)c1ccno1)Nc1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide?
The InChIKey is OZLOODMBUKCFMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FN3O3/c12-7-1-3-8(4-2-7)14-11(17)15-10(16)9-5-6-13-18-9/h1-6H,(H2,14,15,16,17).
What are the key properties of N-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide?
N-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide has a molecular weight of 249.20 g/mol, XLogP of 1.78, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)carbamoyl]-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 2744430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).