3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide

C8H10FNO2S — CID 90296887

IUPAC3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide
SMILESCON(C)C(=O)c1sccc1CF
InChIInChI=1S/C8H10FNO2S/c1-10(12-2)8(11)7-6(5-9)3-4-13-7/h3-4H,5H2,1-2H3
InChIKeyHALBZJFAMIQLNJ-UHFFFAOYSA-N
MW203.24 g/mol
LogP1.85
Rot. Bonds3

About 3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide

3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide (PubChem CID 90296887) has the molecular formula C8H10FNO2S and a molecular weight of 203.24 g/mol. Its IUPAC name is 3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide.

Molecular Properties

Compound Name3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide
PubChem CID90296887
Molecular FormulaC8H10FNO2S
Molecular Weight203.24 g/mol
Exact Mass203.04
IUPAC Name3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide
SMILESCON(C)C(=O)c1sccc1CF
InChIInChI=1S/C8H10FNO2S/c1-10(12-2)8(11)7-6(5-9)3-4-13-7/h3-4H,5H2,1-2H3
InChIKeyHALBZJFAMIQLNJ-UHFFFAOYSA-N
XLogP1.85
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 51.85
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
2-Thiophenecarboxamide, N,N-dimethyl-
CID 141583
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-N-fluoro-3-methylthiophene-2-carboxamide
CID 134853477
N-tert-butyl-3-(fluoromethyl)thiophene-2-carboxamide
CID 134853576
N-(tert-butyl)-3-ethyl-N-fluorothiophene-2-carboxamide
CID 177897422
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
6-Methylthieno[2,3-C]pyridin-7(6H)-one
CID 59680669

Frequently Asked Questions

What is the IUPAC name of 3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide?
The IUPAC name of 3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide (CID 90296887) is 3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide.
What is the SMILES notation for 3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide?
The canonical SMILES for 3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide is CON(C)C(=O)c1sccc1CF.
What is the InChIKey of 3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide?
The InChIKey is HALBZJFAMIQLNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO2S/c1-10(12-2)8(11)7-6(5-9)3-4-13-7/h3-4H,5H2,1-2H3.
What are the key properties of 3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide?
3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide has a molecular weight of 203.24 g/mol, XLogP of 1.85, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(fluoromethyl)-N-methoxy-N-methylthiophene-2-carboxamide is sourced from PubChem (CID 90296887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).