5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide

C16H14N4O2S — CID 155813215

IUPAC5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide
SMILESCC(=O)c1cc2c(N)c(C(=O)Nc3ccccn3)sc2nc1C
InChIInChI=1S/C16H14N4O2S/c1-8-10(9(2)21)7-11-13(17)14(23-16(11)19-8)15(22)20-12-5-3-4-6-18-12/h3-7H,17H2,1-2H3,(H,18,20,22)
InChIKeyUMKFDZVVGKVDQM-UHFFFAOYSA-N
MW326.38 g/mol
LogP3.04
Rot. Bonds3

About 5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide

5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide (PubChem CID 155813215) has the molecular formula C16H14N4O2S and a molecular weight of 326.38 g/mol. Its IUPAC name is 5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide
PubChem CID155813215
Molecular FormulaC16H14N4O2S
Molecular Weight326.38 g/mol
Exact Mass326.08
IUPAC Name5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide
SMILESCC(=O)c1cc2c(N)c(C(=O)Nc3ccccn3)sc2nc1C
InChIInChI=1S/C16H14N4O2S/c1-8-10(9(2)21)7-11-13(17)14(23-16(11)19-8)15(22)20-12-5-3-4-6-18-12/h3-7H,17H2,1-2H3,(H,18,20,22)
InChIKeyUMKFDZVVGKVDQM-UHFFFAOYSA-N
XLogP3.04
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.38
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide (CID 155813215) is 5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide is CC(=O)c1cc2c(N)c(C(=O)Nc3ccccn3)sc2nc1C.
What is the InChIKey of 5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is UMKFDZVVGKVDQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O2S/c1-8-10(9(2)21)7-11-13(17)14(23-16(11)19-8)15(22)20-12-5-3-4-6-18-12/h3-7H,17H2,1-2H3,(H,18,20,22).
What are the key properties of 5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide?
5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 326.38 g/mol, XLogP of 3.04, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetyl-3-amino-6-methyl-N-pyridin-2-ylthieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 155813215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).