2-aminothiophene-3-carboxamide

C5H6N2OS — CID 699495

IUPAC2-aminothiophene-3-carboxamide
SMILESNC(=O)c1ccsc1N
InChIInChI=1S/C5H6N2OS/c6-4(8)3-1-2-9-5(3)7/h1-2H,7H2,(H2,6,8)
InChIKeyWHZIZZOTISTHCT-UHFFFAOYSA-N
MW142.18 g/mol
LogP0.43
Rot. Bonds1

About 2-aminothiophene-3-carboxamide

2-aminothiophene-3-carboxamide (PubChem CID 699495) has the molecular formula C5H6N2OS and a molecular weight of 142.18 g/mol. Its IUPAC name is 2-aminothiophene-3-carboxamide.

Molecular Properties

Compound Name2-aminothiophene-3-carboxamide
PubChem CID699495
Molecular FormulaC5H6N2OS
Molecular Weight142.18 g/mol
Exact Mass142.02
IUPAC Name2-aminothiophene-3-carboxamide
SMILESNC(=O)c1ccsc1N
InChIInChI=1S/C5H6N2OS/c6-4(8)3-1-2-9-5(3)7/h1-2H,7H2,(H2,6,8)
InChIKeyWHZIZZOTISTHCT-UHFFFAOYSA-N
XLogP0.43
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.18
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-aminothiophene-3-carboxamide?
The IUPAC name of 2-aminothiophene-3-carboxamide (CID 699495) is 2-aminothiophene-3-carboxamide.
What is the SMILES notation for 2-aminothiophene-3-carboxamide?
The canonical SMILES for 2-aminothiophene-3-carboxamide is NC(=O)c1ccsc1N.
What is the InChIKey of 2-aminothiophene-3-carboxamide?
The InChIKey is WHZIZZOTISTHCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2OS/c6-4(8)3-1-2-9-5(3)7/h1-2H,7H2,(H2,6,8).
What are the key properties of 2-aminothiophene-3-carboxamide?
2-aminothiophene-3-carboxamide has a molecular weight of 142.18 g/mol, XLogP of 0.43, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminothiophene-3-carboxamide is sourced from PubChem (CID 699495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).