3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide

C15H13N3OS2 — CID 741687

IUPAC3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide
SMILESNC(=O)c1sc2nc(C3CC3)cc(-c3cccs3)c2c1N
InChIInChI=1S/C15H13N3OS2/c16-12-11-8(10-2-1-5-20-10)6-9(7-3-4-7)18-15(11)21-13(12)14(17)19/h1-2,5-7H,3-4,16H2,(H2,17,19)
InChIKeySAFJHRFKZSOHQY-UHFFFAOYSA-N
MW315.42 g/mol
LogP3.58
Rot. Bonds3

About 3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide

3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide (PubChem CID 741687) has the molecular formula C15H13N3OS2 and a molecular weight of 315.42 g/mol. Its IUPAC name is 3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide
PubChem CID741687
Molecular FormulaC15H13N3OS2
Molecular Weight315.42 g/mol
Exact Mass315.05
IUPAC Name3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide
SMILESNC(=O)c1sc2nc(C3CC3)cc(-c3cccs3)c2c1N
InChIInChI=1S/C15H13N3OS2/c16-12-11-8(10-2-1-5-20-10)6-9(7-3-4-7)18-15(11)21-13(12)14(17)19/h1-2,5-7H,3-4,16H2,(H2,17,19)
InChIKeySAFJHRFKZSOHQY-UHFFFAOYSA-N
XLogP3.58
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide (CID 741687) is 3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide is NC(=O)c1sc2nc(C3CC3)cc(-c3cccs3)c2c1N.
What is the InChIKey of 3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is SAFJHRFKZSOHQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3OS2/c16-12-11-8(10-2-1-5-20-10)6-9(7-3-4-7)18-15(11)21-13(12)14(17)19/h1-2,5-7H,3-4,16H2,(H2,17,19).
What are the key properties of 3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide?
3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 315.42 g/mol, XLogP of 3.58, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-cyclopropyl-4-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 741687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).