4-methyl-2-(methylamino)thiophene-3-carboxamide

C7H10N2OS — CID 58799095

IUPAC4-methyl-2-(methylamino)thiophene-3-carboxamide
SMILESCNc1scc(C)c1C(N)=O
InChIInChI=1S/C7H10N2OS/c1-4-3-11-7(9-2)5(4)6(8)10/h3,9H,1-2H3,(H2,8,10)
InChIKeyBEDHHBYLTVJADH-UHFFFAOYSA-N
MW170.24 g/mol
LogP1.20
Rot. Bonds2

About 4-methyl-2-(methylamino)thiophene-3-carboxamide

4-methyl-2-(methylamino)thiophene-3-carboxamide (PubChem CID 58799095) has the molecular formula C7H10N2OS and a molecular weight of 170.24 g/mol. Its IUPAC name is 4-methyl-2-(methylamino)thiophene-3-carboxamide.

Molecular Properties

Compound Name4-methyl-2-(methylamino)thiophene-3-carboxamide
PubChem CID58799095
Molecular FormulaC7H10N2OS
Molecular Weight170.24 g/mol
Exact Mass170.05
IUPAC Name4-methyl-2-(methylamino)thiophene-3-carboxamide
SMILESCNc1scc(C)c1C(N)=O
InChIInChI=1S/C7H10N2OS/c1-4-3-11-7(9-2)5(4)6(8)10/h3,9H,1-2H3,(H2,8,10)
InChIKeyBEDHHBYLTVJADH-UHFFFAOYSA-N
XLogP1.20
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.24
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(methylamino)thiophene-3-carboxamide?
The IUPAC name of 4-methyl-2-(methylamino)thiophene-3-carboxamide (CID 58799095) is 4-methyl-2-(methylamino)thiophene-3-carboxamide.
What is the SMILES notation for 4-methyl-2-(methylamino)thiophene-3-carboxamide?
The canonical SMILES for 4-methyl-2-(methylamino)thiophene-3-carboxamide is CNc1scc(C)c1C(N)=O.
What is the InChIKey of 4-methyl-2-(methylamino)thiophene-3-carboxamide?
The InChIKey is BEDHHBYLTVJADH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2OS/c1-4-3-11-7(9-2)5(4)6(8)10/h3,9H,1-2H3,(H2,8,10).
What are the key properties of 4-methyl-2-(methylamino)thiophene-3-carboxamide?
4-methyl-2-(methylamino)thiophene-3-carboxamide has a molecular weight of 170.24 g/mol, XLogP of 1.20, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(methylamino)thiophene-3-carboxamide is sourced from PubChem (CID 58799095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).