2,3-dimethyl-2H-thiophene-3-carboxamide

C7H11NOS — CID 174944364

IUPAC2,3-dimethyl-2H-thiophene-3-carboxamide
SMILESCC1SC=CC1(C)C(N)=O
InChIInChI=1S/C7H11NOS/c1-5-7(2,6(8)9)3-4-10-5/h3-5H,1-2H3,(H2,8,9)
InChIKeyGZFPIILKKCHHQU-UHFFFAOYSA-N
MW157.24 g/mol
LogP1.13
Rot. Bonds1

About 2,3-dimethyl-2H-thiophene-3-carboxamide

2,3-dimethyl-2H-thiophene-3-carboxamide (PubChem CID 174944364) has the molecular formula C7H11NOS and a molecular weight of 157.24 g/mol. Its IUPAC name is 2,3-dimethyl-2H-thiophene-3-carboxamide.

Molecular Properties

Compound Name2,3-dimethyl-2H-thiophene-3-carboxamide
PubChem CID174944364
Molecular FormulaC7H11NOS
Molecular Weight157.24 g/mol
Exact Mass157.06
IUPAC Name2,3-dimethyl-2H-thiophene-3-carboxamide
SMILESCC1SC=CC1(C)C(N)=O
InChIInChI=1S/C7H11NOS/c1-5-7(2,6(8)9)3-4-10-5/h3-5H,1-2H3,(H2,8,9)
InChIKeyGZFPIILKKCHHQU-UHFFFAOYSA-N
XLogP1.13
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.24
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-2H-thiophene-3-carboxamide?
The IUPAC name of 2,3-dimethyl-2H-thiophene-3-carboxamide (CID 174944364) is 2,3-dimethyl-2H-thiophene-3-carboxamide.
What is the SMILES notation for 2,3-dimethyl-2H-thiophene-3-carboxamide?
The canonical SMILES for 2,3-dimethyl-2H-thiophene-3-carboxamide is CC1SC=CC1(C)C(N)=O.
What is the InChIKey of 2,3-dimethyl-2H-thiophene-3-carboxamide?
The InChIKey is GZFPIILKKCHHQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-5-7(2,6(8)9)3-4-10-5/h3-5H,1-2H3,(H2,8,9).
What are the key properties of 2,3-dimethyl-2H-thiophene-3-carboxamide?
2,3-dimethyl-2H-thiophene-3-carboxamide has a molecular weight of 157.24 g/mol, XLogP of 1.13, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-2H-thiophene-3-carboxamide is sourced from PubChem (CID 174944364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).