5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide

C12H11FN2O2 — CID 37338212

IUPAC5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide
SMILESCN(C)C(=O)c1cc(-c2ccccc2F)on1
InChIInChI=1S/C12H11FN2O2/c1-15(2)12(16)10-7-11(17-14-10)8-5-3-4-6-9(8)13/h3-7H,1-2H3
InChIKeyBQAWRHFLNGXIKZ-UHFFFAOYSA-N
MW234.23 g/mol
LogP2.18
Rot. Bonds2

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

5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide (PubChem CID 37338212) has the molecular formula C12H11FN2O2 and a molecular weight of 234.23 g/mol. Its IUPAC name is 5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide
PubChem CID37338212
Molecular FormulaC12H11FN2O2
Molecular Weight234.23 g/mol
Exact Mass234.08
IUPAC Name5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide
SMILESCN(C)C(=O)c1cc(-c2ccccc2F)on1
InChIInChI=1S/C12H11FN2O2/c1-15(2)12(16)10-7-11(17-14-10)8-5-3-4-6-9(8)13/h3-7H,1-2H3
InChIKeyBQAWRHFLNGXIKZ-UHFFFAOYSA-N
XLogP2.18
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.23
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide
CID 55637945
5-(2-fluorophenyl)-N-phenyl-1,2-oxazole-3-carboxamide
CID 46480950
5-(2-fluorophenyl)-N-[3-(methanesulfonamido)propyl]-1,2-oxazole-3-carboxamide
CID 53498114
5-(3-fluoro-2-methylphenyl)-1,2-oxazole-3-carboxylic acid
CID 117315177
5-(2-fluorophenyl)-3-(trifluoromethyl)-1,2-oxazole
CID 116861916
1-[5-(2-fluorophenyl)-1,2-oxazol-3-yl]-N-methyl-N-phenylcyclopropane-1-carboxamide
CID 90503457
N-[(3S)-2,3-dihydro-1-benzofuran-3-yl]-5-(2-fluorophenyl)-1,2-oxazole-3-carboxamide
CID 94828983
5-(2-fluorophenyl)-N-[2-(furan-2-yl)-2-hydroxypropyl]-1,2-oxazole-3-carboxamide
CID 111482143
5-(2-fluorophenyl)-N-[2-(trifluoromethyl)cyclohexyl]-1,2-oxazole-3-carboxamide
CID 55639151
N-[4-(cyclopropylcarbamoylamino)phenyl]-5-(2-fluorophenyl)-1,2-oxazole-3-carboxamide
CID 37342518
[5-(2-fluorophenyl)-1,2-oxazol-3-yl]-[(2S)-2-[(2R)-1-methylpyrrolidin-2-yl]pyrrolidin-1-yl]methanone
CID 95302784
N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide
CID 27370057

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide (CID 37338212) is 5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide is CN(C)C(=O)c1cc(-c2ccccc2F)on1.
What is the InChIKey of 5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide?
The InChIKey is BQAWRHFLNGXIKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2O2/c1-15(2)12(16)10-7-11(17-14-10)8-5-3-4-6-9(8)13/h3-7H,1-2H3.
What are the key properties of 5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide?
5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide has a molecular weight of 234.23 g/mol, XLogP of 2.18, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 37338212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).