5-amino-N-methylthiophene-3-carboxamide

C6H8N2OS — CID 131326009

IUPAC5-amino-N-methylthiophene-3-carboxamide
SMILESCNC(=O)c1csc(N)c1
InChIInChI=1S/C6H8N2OS/c1-8-6(9)4-2-5(7)10-3-4/h2-3H,7H2,1H3,(H,8,9)
InChIKeyATPDCGOKEBXPKM-UHFFFAOYSA-N
MW156.21 g/mol
LogP0.69
Rot. Bonds1

About 5-amino-N-methylthiophene-3-carboxamide

5-amino-N-methylthiophene-3-carboxamide (PubChem CID 131326009) has the molecular formula C6H8N2OS and a molecular weight of 156.21 g/mol. Its IUPAC name is 5-amino-N-methylthiophene-3-carboxamide.

Molecular Properties

Compound Name5-amino-N-methylthiophene-3-carboxamide
PubChem CID131326009
Molecular FormulaC6H8N2OS
Molecular Weight156.21 g/mol
Exact Mass156.04
IUPAC Name5-amino-N-methylthiophene-3-carboxamide
SMILESCNC(=O)c1csc(N)c1
InChIInChI=1S/C6H8N2OS/c1-8-6(9)4-2-5(7)10-3-4/h2-3H,7H2,1H3,(H,8,9)
InChIKeyATPDCGOKEBXPKM-UHFFFAOYSA-N
XLogP0.69
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.21
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-amino-N-methylthiophene-3-carboxamide?
The IUPAC name of 5-amino-N-methylthiophene-3-carboxamide (CID 131326009) is 5-amino-N-methylthiophene-3-carboxamide.
What is the SMILES notation for 5-amino-N-methylthiophene-3-carboxamide?
The canonical SMILES for 5-amino-N-methylthiophene-3-carboxamide is CNC(=O)c1csc(N)c1.
What is the InChIKey of 5-amino-N-methylthiophene-3-carboxamide?
The InChIKey is ATPDCGOKEBXPKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2OS/c1-8-6(9)4-2-5(7)10-3-4/h2-3H,7H2,1H3,(H,8,9).
What are the key properties of 5-amino-N-methylthiophene-3-carboxamide?
5-amino-N-methylthiophene-3-carboxamide has a molecular weight of 156.21 g/mol, XLogP of 0.69, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-methylthiophene-3-carboxamide is sourced from PubChem (CID 131326009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).