3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide

C10H9FN2O2 — CID 90825451

IUPAC3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide
SMILESNC(=O)N1OCC=C1c1cccc(F)c1
InChIInChI=1S/C10H9FN2O2/c11-8-3-1-2-7(6-8)9-4-5-15-13(9)10(12)14/h1-4,6H,5H2,(H2,12,14)
InChIKeyJCGRXQYCKINSKB-UHFFFAOYSA-N
MW208.19 g/mol
LogP1.49
Rot. Bonds1

About 3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide

3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide (PubChem CID 90825451) has the molecular formula C10H9FN2O2 and a molecular weight of 208.19 g/mol. Its IUPAC name is 3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide.

Molecular Properties

Compound Name3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide
PubChem CID90825451
Molecular FormulaC10H9FN2O2
Molecular Weight208.19 g/mol
Exact Mass208.06
IUPAC Name3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide
SMILESNC(=O)N1OCC=C1c1cccc(F)c1
InChIInChI=1S/C10H9FN2O2/c11-8-3-1-2-7(6-8)9-4-5-15-13(9)10(12)14/h1-4,6H,5H2,(H2,12,14)
InChIKeyJCGRXQYCKINSKB-UHFFFAOYSA-N
XLogP1.49
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.19
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[[3-(4-Fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]-1-hydroxyurea
CID 57012206
1-[1-[3-(4-Fluorophenyl)-2,5-dihydro-1,2-oxazol-5-yl]ethyl]-1-hydroxyurea
CID 57013220
1-[[3-(4-Fluorophenyl)-2,5-dihydro-1,2-oxazol-4-yl]methyl]-1-hydroxyurea
CID 57095982
1-[[3-(4-Fluorophenyl)-5-methyl-2,5-dihydro-1,2-oxazol-4-yl]methyl]-1-hydroxyurea
CID 57161067
3-(4-Fluorophenyl)-5-methyl-2,5-dihydro-1,2-oxazole
CID 91587883
4-(3-Fluorophenyl)-5-methyl-1,3-dihydroimidazol-2-one
CID 105445731
4-(4-Fluorophenyl)-5-methyl-1,3-dihydroimidazol-2-one
CID 105445732
4-(2-Fluorophenyl)-5-methyl-1,3-dihydroimidazol-2-one
CID 105445733
4-Ethyl-5-(3-fluorophenyl)-1,3-dihydroimidazol-2-one
CID 105458492
4-Ethyl-5-(4-fluorophenyl)-1,3-dihydroimidazol-2-one
CID 105458493
4-Ethyl-5-(2-fluorophenyl)-1,3-dihydroimidazol-2-one
CID 105458494
1-[Difluoro-(2-fluorophenyl)methyl]-1-hydroxyurea
CID 150419702

Frequently Asked Questions

What is the IUPAC name of 3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide?
The IUPAC name of 3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide (CID 90825451) is 3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide.
What is the SMILES notation for 3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide?
The canonical SMILES for 3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide is NC(=O)N1OCC=C1c1cccc(F)c1.
What is the InChIKey of 3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide?
The InChIKey is JCGRXQYCKINSKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O2/c11-8-3-1-2-7(6-8)9-4-5-15-13(9)10(12)14/h1-4,6H,5H2,(H2,12,14).
What are the key properties of 3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide?
3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide has a molecular weight of 208.19 g/mol, XLogP of 1.49, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluorophenyl)-5H-1,2-oxazole-2-carboxamide is sourced from PubChem (CID 90825451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).