N-[5-[[2-(6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)acetyl]amino]-2-methyl-3-pyridinyl]-7-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxamide

C25H24N10O2S — CID 170634305

About N-[5-[[2-(6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)acetyl]amino]-2-methyl-3-pyridinyl]-7-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxamide

N-[5-[[2-(6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)acetyl]amino]-2-methyl-3-pyridinyl]-7-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxamide (PubChem CID 170634305) has the molecular formula C25H24N10O2S and a molecular weight of 528.60 g/mol. Its IUPAC name is N-[5-[[2-(6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)acetyl]amino]-2-methyl-3-pyridinyl]-7-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[5-[[2-(6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)acetyl]amino]-2-methyl-3-pyridinyl]-7-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxamide
• PubChem CID: 170634305
• Molecular Formula: C25H24N10O2S
• Molecular Weight: 528.60 g/mol
• Exact Mass: 528.18
• IUPAC Name: N-[5-[[2-(6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)acetyl]amino]-2-methyl-3-pyridinyl]-7-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxamide
• SMILES: Cc1ncc(NC(=O)CN2CCc3scnc3C2)cc1NC(=O)c1nnc2cc(-c3cnn(C)c3)ccn12
• InChI: InChI=1S/C25H24N10O2S/c1-15-19(8-18(10-26-15)29-23(36)13-34-5-4-21-20(12-34)27-14-38-21)30-25(37)24-32-31-22-7-16(3-6-35(22)24)17-9-28-33(2)11-17/h3,6-11,14H,4-5,12-13H2,1-2H3,(H,29,36)(H,30,37)
• InChIKey: UHRJZBUCIZIWGN-UHFFFAOYSA-N
• XLogP: 2.54
• TPSA: 135.23 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 11
• Rotatable Bonds: 6
• Heavy Atoms: 38
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	528.60
LogP ≤ 5	2.54
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	11

Frequently Asked Questions

What is the IUPAC name of N-[5-[[2-(6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)acetyl]amino]-2-methyl-3-pyridinyl]-7-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxamide?

The IUPAC name of N-[5-[[2-(6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)acetyl]amino]-2-methyl-3-pyridinyl]-7-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxamide (CID 170634305) is N-[5-[[2-(6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)acetyl]amino]-2-methyl-3-pyridinyl]-7-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxamide.

What is the SMILES notation for N-[5-[[2-(6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)acetyl]amino]-2-methyl-3-pyridinyl]-7-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxamide?

The canonical SMILES for N-[5-[[2-(6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)acetyl]amino]-2-methyl-3-pyridinyl]-7-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxamide is Cc1ncc(NC(=O)CN2CCc3scnc3C2)cc1NC(=O)c1nnc2cc(-c3cnn(C)c3)ccn12.

What is the InChIKey of N-[5-[[2-(6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)acetyl]amino]-2-methyl-3-pyridinyl]-7-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxamide?

The InChIKey is UHRJZBUCIZIWGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N10O2S/c1-15-19(8-18(10-26-15)29-23(36)13-34-5-4-21-20(12-34)27-14-38-21)30-25(37)24-32-31-22-7-16(3-6-35(22)24)17-9-28-33(2)11-17/h3,6-11,14H,4-5,12-13H2,1-2H3,(H,29,36)(H,30,37).

What are the key properties of N-[5-[[2-(6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)acetyl]amino]-2-methyl-3-pyridinyl]-7-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxamide?

N-[5-[[2-(6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)acetyl]amino]-2-methyl-3-pyridinyl]-7-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxamide has a molecular weight of 528.60 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-[[2-(6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)acetyl]amino]-2-methyl-3-pyridinyl]-7-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxamide is sourced from PubChem (CID 170634305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).