1-[5-methoxy-8-(1-oxo-2,3-dihydroinden-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-propan-2-ylcyclopropane-1-carboxamide

C23H24N4O3 — CID 58074615

About 1-[5-methoxy-8-(1-oxo-2,3-dihydroinden-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-propan-2-ylcyclopropane-1-carboxamide

1-[5-methoxy-8-(1-oxo-2,3-dihydroinden-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-propan-2-ylcyclopropane-1-carboxamide (PubChem CID 58074615) has the molecular formula C23H24N4O3 and a molecular weight of 404.47 g/mol. Its IUPAC name is 1-[5-methoxy-8-(1-oxo-2,3-dihydroinden-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-propan-2-ylcyclopropane-1-carboxamide.

Molecular Properties

• Compound Name: 1-[5-methoxy-8-(1-oxo-2,3-dihydroinden-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-propan-2-ylcyclopropane-1-carboxamide
• PubChem CID: 58074615
• Molecular Formula: C23H24N4O3
• Molecular Weight: 404.47 g/mol
• Exact Mass: 404.18
• IUPAC Name: 1-[5-methoxy-8-(1-oxo-2,3-dihydroinden-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-propan-2-ylcyclopropane-1-carboxamide
• SMILES: COc1ccc(-c2ccc3c(c2)CCC3=O)c2nc(C3(C(=O)NC(C)C)CC3)nn12
• InChI: InChI=1S/C23H24N4O3/c1-13(2)24-22(29)23(10-11-23)21-25-20-17(7-9-19(30-3)27(20)26-21)15-4-6-16-14(12-15)5-8-18(16)28/h4,6-7,9,12-13H,5,8,10-11H2,1-3H3,(H,24,29)
• InChIKey: ZOQWLCAXVSPEPF-UHFFFAOYSA-N
• XLogP: 3.09
• TPSA: 85.59 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	404.47
LogP ≤ 5	3.09
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 1-[5-methoxy-8-(1-oxo-2,3-dihydroinden-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-propan-2-ylcyclopropane-1-carboxamide?

The IUPAC name of 1-[5-methoxy-8-(1-oxo-2,3-dihydroinden-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-propan-2-ylcyclopropane-1-carboxamide (CID 58074615) is 1-[5-methoxy-8-(1-oxo-2,3-dihydroinden-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-propan-2-ylcyclopropane-1-carboxamide.

What is the SMILES notation for 1-[5-methoxy-8-(1-oxo-2,3-dihydroinden-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-propan-2-ylcyclopropane-1-carboxamide?

The canonical SMILES for 1-[5-methoxy-8-(1-oxo-2,3-dihydroinden-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-propan-2-ylcyclopropane-1-carboxamide is COc1ccc(-c2ccc3c(c2)CCC3=O)c2nc(C3(C(=O)NC(C)C)CC3)nn12.

What is the InChIKey of 1-[5-methoxy-8-(1-oxo-2,3-dihydroinden-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-propan-2-ylcyclopropane-1-carboxamide?

The InChIKey is ZOQWLCAXVSPEPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O3/c1-13(2)24-22(29)23(10-11-23)21-25-20-17(7-9-19(30-3)27(20)26-21)15-4-6-16-14(12-15)5-8-18(16)28/h4,6-7,9,12-13H,5,8,10-11H2,1-3H3,(H,24,29).

What are the key properties of 1-[5-methoxy-8-(1-oxo-2,3-dihydroinden-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-propan-2-ylcyclopropane-1-carboxamide?

1-[5-methoxy-8-(1-oxo-2,3-dihydroinden-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-propan-2-ylcyclopropane-1-carboxamide has a molecular weight of 404.47 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[5-methoxy-8-(1-oxo-2,3-dihydroinden-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-propan-2-ylcyclopropane-1-carboxamide is sourced from PubChem (CID 58074615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).