3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide

C12H9N3O2S — CID 134168381

IUPAC3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide
SMILESNC(=O)c1sc2cncc(-c3ccoc3)c2c1N
InChIInChI=1S/C12H9N3O2S/c13-10-9-7(6-1-2-17-5-6)3-15-4-8(9)18-11(10)12(14)16/h1-5H,13H2,(H2,14,16)
InChIKeyHYGVVCNMLROUDV-UHFFFAOYSA-N
MW259.29 g/mol
LogP2.24
Rot. Bonds2

About 3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide

3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide (PubChem CID 134168381) has the molecular formula C12H9N3O2S and a molecular weight of 259.29 g/mol. Its IUPAC name is 3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide
PubChem CID134168381
Molecular FormulaC12H9N3O2S
Molecular Weight259.29 g/mol
Exact Mass259.04
IUPAC Name3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide
SMILESNC(=O)c1sc2cncc(-c3ccoc3)c2c1N
InChIInChI=1S/C12H9N3O2S/c13-10-9-7(6-1-2-17-5-6)3-15-4-8(9)18-11(10)12(14)16/h1-5H,13H2,(H2,14,16)
InChIKeyHYGVVCNMLROUDV-UHFFFAOYSA-N
XLogP2.24
TPSA95.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.29
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide?
The IUPAC name of 3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide (CID 134168381) is 3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide is NC(=O)c1sc2cncc(-c3ccoc3)c2c1N.
What is the InChIKey of 3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide?
The InChIKey is HYGVVCNMLROUDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3O2S/c13-10-9-7(6-1-2-17-5-6)3-15-4-8(9)18-11(10)12(14)16/h1-5H,13H2,(H2,14,16).
What are the key properties of 3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide?
3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide has a molecular weight of 259.29 g/mol, XLogP of 2.24, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-(furan-3-yl)thieno[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 134168381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).