3-amino-N-thiophen-3-ylpyridine-4-carboxamide

C10H9N3OS — CID 105070561

IUPAC3-amino-N-thiophen-3-ylpyridine-4-carboxamide
SMILESNc1cnccc1C(=O)Nc1ccsc1
InChIInChI=1S/C10H9N3OS/c11-9-5-12-3-1-8(9)10(14)13-7-2-4-15-6-7/h1-6H,11H2,(H,13,14)
InChIKeyNQGGEVWHUFJTHO-UHFFFAOYSA-N
MW219.27 g/mol
LogP1.98
Rot. Bonds2

About 3-amino-N-thiophen-3-ylpyridine-4-carboxamide

3-amino-N-thiophen-3-ylpyridine-4-carboxamide (PubChem CID 105070561) has the molecular formula C10H9N3OS and a molecular weight of 219.27 g/mol. Its IUPAC name is 3-amino-N-thiophen-3-ylpyridine-4-carboxamide.

Molecular Properties

Compound Name3-amino-N-thiophen-3-ylpyridine-4-carboxamide
PubChem CID105070561
Molecular FormulaC10H9N3OS
Molecular Weight219.27 g/mol
Exact Mass219.05
IUPAC Name3-amino-N-thiophen-3-ylpyridine-4-carboxamide
SMILESNc1cnccc1C(=O)Nc1ccsc1
InChIInChI=1S/C10H9N3OS/c11-9-5-12-3-1-8(9)10(14)13-7-2-4-15-6-7/h1-6H,11H2,(H,13,14)
InChIKeyNQGGEVWHUFJTHO-UHFFFAOYSA-N
XLogP1.98
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.27
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-thiophen-3-ylpyridine-4-carboxamide?
The IUPAC name of 3-amino-N-thiophen-3-ylpyridine-4-carboxamide (CID 105070561) is 3-amino-N-thiophen-3-ylpyridine-4-carboxamide.
What is the SMILES notation for 3-amino-N-thiophen-3-ylpyridine-4-carboxamide?
The canonical SMILES for 3-amino-N-thiophen-3-ylpyridine-4-carboxamide is Nc1cnccc1C(=O)Nc1ccsc1.
What is the InChIKey of 3-amino-N-thiophen-3-ylpyridine-4-carboxamide?
The InChIKey is NQGGEVWHUFJTHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3OS/c11-9-5-12-3-1-8(9)10(14)13-7-2-4-15-6-7/h1-6H,11H2,(H,13,14).
What are the key properties of 3-amino-N-thiophen-3-ylpyridine-4-carboxamide?
3-amino-N-thiophen-3-ylpyridine-4-carboxamide has a molecular weight of 219.27 g/mol, XLogP of 1.98, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-thiophen-3-ylpyridine-4-carboxamide is sourced from PubChem (CID 105070561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).