N-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide

C8H8F3NO2S — CID 88594126

IUPACN-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide
SMILESCON(C)C(=O)c1sccc1C(F)(F)F
InChIInChI=1S/C8H8F3NO2S/c1-12(14-2)7(13)6-5(3-4-15-6)8(9,10)11/h3-4H,1-2H3
InChIKeyFSTDMNYGAAQLMD-UHFFFAOYSA-N
MW239.22 g/mol
LogP2.40
Rot. Bonds2

About N-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide

N-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide (PubChem CID 88594126) has the molecular formula C8H8F3NO2S and a molecular weight of 239.22 g/mol. Its IUPAC name is N-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide
PubChem CID88594126
Molecular FormulaC8H8F3NO2S
Molecular Weight239.22 g/mol
Exact Mass239.02
IUPAC NameN-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide
SMILESCON(C)C(=O)c1sccc1C(F)(F)F
InChIInChI=1S/C8H8F3NO2S/c1-12(14-2)7(13)6-5(3-4-15-6)8(9,10)11/h3-4H,1-2H3
InChIKeyFSTDMNYGAAQLMD-UHFFFAOYSA-N
XLogP2.40
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.22
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-Methoxy-N-methyl-2-thiophenecarboxamide
CID 3613942
1-[4-(3-Ethylthiophene-2-carbonyl)piperazin-1-yl]-3,3,3-trifluoropropan-1-one
CID 51099293
N,N,3-trimethylthiophene-2-carboxamide
CID 20484171
3,3,3-trifluoro-N-hydroxy-2,2-dimethyl-N-[(3-methylthiophen-2-yl)methyl]propanamide
CID 156784546
N-tert-butyl-3-(2,2,2-trifluoroethyl)thiophene-2-carboxamide
CID 138963599
N-Methoxy-N,5-dimethylthiophene-2-carboxamide
CID 10845216
N,3-dimethylthiophene-2-carboxamide
CID 22311423
N~2~,N~5~-Dimethoxy-N~2~,N~5~-dimethylthiophene-2,5-dicarboxamide
CID 58793342
N-(2,2-difluoroethyl)-2-methylthiophene-3-carboxamide
CID 126790727
3-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide
CID 40235134
CID 59369503
CID 59369503
3-[(4-fluorophenyl)methyl]-N-methoxy-N-methylthiophene-2-carboxamide
CID 60125713

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide?
The IUPAC name of N-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide (CID 88594126) is N-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide.
What is the SMILES notation for N-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide?
The canonical SMILES for N-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide is CON(C)C(=O)c1sccc1C(F)(F)F.
What is the InChIKey of N-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide?
The InChIKey is FSTDMNYGAAQLMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3NO2S/c1-12(14-2)7(13)6-5(3-4-15-6)8(9,10)11/h3-4H,1-2H3.
What are the key properties of N-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide?
N-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide has a molecular weight of 239.22 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methyl-3-(trifluoromethyl)thiophene-2-carboxamide is sourced from PubChem (CID 88594126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).