2-acetamido-4-methylthiophene-3-carboxamide

C8H10N2O2S — CID 2807708

IUPAC2-acetamido-4-methylthiophene-3-carboxamide
SMILESCC(=O)Nc1scc(C)c1C(N)=O
InChIInChI=1S/C8H10N2O2S/c1-4-3-13-8(10-5(2)11)6(4)7(9)12/h3H,1-2H3,(H2,9,12)(H,10,11)
InChIKeyAHGPFJVXAMTZCD-UHFFFAOYSA-N
MW198.25 g/mol
LogP1.11
Rot. Bonds2

About 2-acetamido-4-methylthiophene-3-carboxamide

2-acetamido-4-methylthiophene-3-carboxamide (PubChem CID 2807708) has the molecular formula C8H10N2O2S and a molecular weight of 198.25 g/mol. Its IUPAC name is 2-acetamido-4-methylthiophene-3-carboxamide.

Molecular Properties

Compound Name2-acetamido-4-methylthiophene-3-carboxamide
PubChem CID2807708
Molecular FormulaC8H10N2O2S
Molecular Weight198.25 g/mol
Exact Mass198.05
IUPAC Name2-acetamido-4-methylthiophene-3-carboxamide
SMILESCC(=O)Nc1scc(C)c1C(N)=O
InChIInChI=1S/C8H10N2O2S/c1-4-3-13-8(10-5(2)11)6(4)7(9)12/h3H,1-2H3,(H2,9,12)(H,10,11)
InChIKeyAHGPFJVXAMTZCD-UHFFFAOYSA-N
XLogP1.11
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.25
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-4-methylthiophene-3-carboxamide
CID 293810
2-(Cyclopropanecarbonylamino)thiophene-3-carboxamide
CID 3321377
2-(Butanoylamino)thiophene-3-carboxamide
CID 2970903
2-Acetamidothiophene-3-carboxamide
CID 6852048
2-Pivalamidothiophene-3-carboxamide
CID 7164100
2-[(Trifluoroacetyl)amino]thiophene-3-carboxamide
CID 23119838
N,4-dimethyl-2-[(2,2,2-trifluoroacetyl)amino]thiophene-3-carboxamide
CID 2807710
4-Methyl-2-[(2,2,2-trifluoroacetyl)amino]thiophene-3-carboxamide
CID 2807628
2-(2-Chloropropanamido)thiophene-3-carboxamide
CID 16227000
2-Propionylamino-3-thenamide
CID 7164098
2-Isobutyramidothiophene-3-carboxamide
CID 7167015
S-(2-((3-(methylcarbamoyl)thiophen-2-yl)amino)-2-oxoethyl) ethanethioate
CID 16949197

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-4-methylthiophene-3-carboxamide?
The IUPAC name of 2-acetamido-4-methylthiophene-3-carboxamide (CID 2807708) is 2-acetamido-4-methylthiophene-3-carboxamide.
What is the SMILES notation for 2-acetamido-4-methylthiophene-3-carboxamide?
The canonical SMILES for 2-acetamido-4-methylthiophene-3-carboxamide is CC(=O)Nc1scc(C)c1C(N)=O.
What is the InChIKey of 2-acetamido-4-methylthiophene-3-carboxamide?
The InChIKey is AHGPFJVXAMTZCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2S/c1-4-3-13-8(10-5(2)11)6(4)7(9)12/h3H,1-2H3,(H2,9,12)(H,10,11).
What are the key properties of 2-acetamido-4-methylthiophene-3-carboxamide?
2-acetamido-4-methylthiophene-3-carboxamide has a molecular weight of 198.25 g/mol, XLogP of 1.11, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-4-methylthiophene-3-carboxamide is sourced from PubChem (CID 2807708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).