6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide

C22H24N6O2S — CID 176673209

IUPAC6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide
SMILESCNc1nccc2cc(-c3c(C(N)=O)c(CC(C)C)nc(C)c3-c3nnc(C)o3)sc12
InChIInChI=1S/C22H24N6O2S/c1-10(2)8-14-17(20(23)29)18(16(11(3)26-14)22-28-27-12(4)30-22)15-9-13-6-7-25-21(24-5)19(13)31-15/h6-7,9-10H,8H2,1-5H3,(H2,23,29)(H,24,25)
InChIKeyLUARDTVOGKNQNW-UHFFFAOYSA-N
MW436.54 g/mol
LogP4.36
Rot. Bonds6

About 6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide

6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide (PubChem CID 176673209) has the molecular formula C22H24N6O2S and a molecular weight of 436.54 g/mol. Its IUPAC name is 6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide
PubChem CID176673209
Molecular FormulaC22H24N6O2S
Molecular Weight436.54 g/mol
Exact Mass436.17
IUPAC Name6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide
SMILESCNc1nccc2cc(-c3c(C(N)=O)c(CC(C)C)nc(C)c3-c3nnc(C)o3)sc12
InChIInChI=1S/C22H24N6O2S/c1-10(2)8-14-17(20(23)29)18(16(11(3)26-14)22-28-27-12(4)30-22)15-9-13-6-7-25-21(24-5)19(13)31-15/h6-7,9-10H,8H2,1-5H3,(H2,23,29)(H,24,25)
InChIKeyLUARDTVOGKNQNW-UHFFFAOYSA-N
XLogP4.36
TPSA119.82 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.54
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide?
The IUPAC name of 6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide (CID 176673209) is 6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide is CNc1nccc2cc(-c3c(C(N)=O)c(CC(C)C)nc(C)c3-c3nnc(C)o3)sc12.
What is the InChIKey of 6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide?
The InChIKey is LUARDTVOGKNQNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N6O2S/c1-10(2)8-14-17(20(23)29)18(16(11(3)26-14)22-28-27-12(4)30-22)15-9-13-6-7-25-21(24-5)19(13)31-15/h6-7,9-10H,8H2,1-5H3,(H2,23,29)(H,24,25).
What are the key properties of 6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide?
6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide has a molecular weight of 436.54 g/mol, XLogP of 4.36, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-[7-(methylamino)thieno[2,3-c]pyridin-2-yl]-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpropyl)pyridine-3-carboxamide is sourced from PubChem (CID 176673209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).