3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide

C20H16N4O2S — CID 3518029

IUPAC3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2sc3nc(-c4cccnc4)ccc3c2N)cc1
InChIInChI=1S/C20H16N4O2S/c1-26-14-6-4-13(5-7-14)23-19(25)18-17(21)15-8-9-16(24-20(15)27-18)12-3-2-10-22-11-12/h2-11H,21H2,1H3,(H,23,25)
InChIKeyFWNSLTYTSOJHOP-UHFFFAOYSA-N
MW376.44 g/mol
LogP4.20
Rot. Bonds4

About 3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide

3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide (PubChem CID 3518029) has the molecular formula C20H16N4O2S and a molecular weight of 376.44 g/mol. Its IUPAC name is 3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide
PubChem CID3518029
Molecular FormulaC20H16N4O2S
Molecular Weight376.44 g/mol
Exact Mass376.10
IUPAC Name3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2sc3nc(-c4cccnc4)ccc3c2N)cc1
InChIInChI=1S/C20H16N4O2S/c1-26-14-6-4-13(5-7-14)23-19(25)18-17(21)15-8-9-16(24-20(15)27-18)12-3-2-10-22-11-12/h2-11H,21H2,1H3,(H,23,25)
InChIKeyFWNSLTYTSOJHOP-UHFFFAOYSA-N
XLogP4.20
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.44
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide (CID 3518029) is 3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide is COc1ccc(NC(=O)c2sc3nc(-c4cccnc4)ccc3c2N)cc1.
What is the InChIKey of 3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is FWNSLTYTSOJHOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O2S/c1-26-14-6-4-13(5-7-14)23-19(25)18-17(21)15-8-9-16(24-20(15)27-18)12-3-2-10-22-11-12/h2-11H,21H2,1H3,(H,23,25).
What are the key properties of 3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide?
3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 376.44 g/mol, XLogP of 4.20, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-methoxyphenyl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 3518029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).