2-N,2-N-dimethylthiophene-2,5-dicarboxamide

C8H10N2O2S — CID 126988322

IUPAC2-N,2-N-dimethylthiophene-2,5-dicarboxamide
SMILESCN(C)C(=O)c1ccc(C(N)=O)s1
InChIInChI=1S/C8H10N2O2S/c1-10(2)8(12)6-4-3-5(13-6)7(9)11/h3-4H,1-2H3,(H2,9,11)
InChIKeyNZNUKZYEXAUXPI-UHFFFAOYSA-N
MW198.25 g/mol
LogP0.55
Rot. Bonds2

About 2-N,2-N-dimethylthiophene-2,5-dicarboxamide

2-N,2-N-dimethylthiophene-2,5-dicarboxamide (PubChem CID 126988322) has the molecular formula C8H10N2O2S and a molecular weight of 198.25 g/mol. Its IUPAC name is 2-N,2-N-dimethylthiophene-2,5-dicarboxamide.

Molecular Properties

Compound Name2-N,2-N-dimethylthiophene-2,5-dicarboxamide
PubChem CID126988322
Molecular FormulaC8H10N2O2S
Molecular Weight198.25 g/mol
Exact Mass198.05
IUPAC Name2-N,2-N-dimethylthiophene-2,5-dicarboxamide
SMILESCN(C)C(=O)c1ccc(C(N)=O)s1
InChIInChI=1S/C8H10N2O2S/c1-10(2)8(12)6-4-3-5(13-6)7(9)11/h3-4H,1-2H3,(H2,9,11)
InChIKeyNZNUKZYEXAUXPI-UHFFFAOYSA-N
XLogP0.55
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.25
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethylthiophene-2,5-dicarboxamide?
The IUPAC name of 2-N,2-N-dimethylthiophene-2,5-dicarboxamide (CID 126988322) is 2-N,2-N-dimethylthiophene-2,5-dicarboxamide.
What is the SMILES notation for 2-N,2-N-dimethylthiophene-2,5-dicarboxamide?
The canonical SMILES for 2-N,2-N-dimethylthiophene-2,5-dicarboxamide is CN(C)C(=O)c1ccc(C(N)=O)s1.
What is the InChIKey of 2-N,2-N-dimethylthiophene-2,5-dicarboxamide?
The InChIKey is NZNUKZYEXAUXPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2S/c1-10(2)8(12)6-4-3-5(13-6)7(9)11/h3-4H,1-2H3,(H2,9,11).
What are the key properties of 2-N,2-N-dimethylthiophene-2,5-dicarboxamide?
2-N,2-N-dimethylthiophene-2,5-dicarboxamide has a molecular weight of 198.25 g/mol, XLogP of 0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethylthiophene-2,5-dicarboxamide is sourced from PubChem (CID 126988322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).