4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide

C10H13F3N2OS — CID 55006353

IUPAC4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide
SMILESCCN(CC(F)(F)F)C(=O)c1cc(N)c(C)s1
InChIInChI=1S/C10H13F3N2OS/c1-3-15(5-10(11,12)13)9(16)8-4-7(14)6(2)17-8/h4H,3,5,14H2,1-2H3
InChIKeySXCDWZAAOVFSDU-UHFFFAOYSA-N
MW266.29 g/mol
LogP2.66
Rot. Bonds3

About 4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide

4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide (PubChem CID 55006353) has the molecular formula C10H13F3N2OS and a molecular weight of 266.29 g/mol. Its IUPAC name is 4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide
PubChem CID55006353
Molecular FormulaC10H13F3N2OS
Molecular Weight266.29 g/mol
Exact Mass266.07
IUPAC Name4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide
SMILESCCN(CC(F)(F)F)C(=O)c1cc(N)c(C)s1
InChIInChI=1S/C10H13F3N2OS/c1-3-15(5-10(11,12)13)9(16)8-4-7(14)6(2)17-8/h4H,3,5,14H2,1-2H3
InChIKeySXCDWZAAOVFSDU-UHFFFAOYSA-N
XLogP2.66
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.29
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide?
The IUPAC name of 4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide (CID 55006353) is 4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide.
What is the SMILES notation for 4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide?
The canonical SMILES for 4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide is CCN(CC(F)(F)F)C(=O)c1cc(N)c(C)s1.
What is the InChIKey of 4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide?
The InChIKey is SXCDWZAAOVFSDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N2OS/c1-3-15(5-10(11,12)13)9(16)8-4-7(14)6(2)17-8/h4H,3,5,14H2,1-2H3.
What are the key properties of 4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide?
4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide has a molecular weight of 266.29 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-ethyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide is sourced from PubChem (CID 55006353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).