N-[3-cyclopropyl-1-[6-(2-oxa-7-azaspiro[3.4]octan-7-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide

C22H24N6O2 — CID 170577482

About N-[3-cyclopropyl-1-[6-(2-oxa-7-azaspiro[3.4]octan-7-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide

N-[3-cyclopropyl-1-[6-(2-oxa-7-azaspiro[3.4]octan-7-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide (PubChem CID 170577482) has the molecular formula C22H24N6O2 and a molecular weight of 404.47 g/mol. Its IUPAC name is N-[3-cyclopropyl-1-[6-(2-oxa-7-azaspiro[3.4]octan-7-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide.

Molecular Properties

• Compound Name: N-[3-cyclopropyl-1-[6-(2-oxa-7-azaspiro[3.4]octan-7-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide
• PubChem CID: 170577482
• Molecular Formula: C22H24N6O2
• Molecular Weight: 404.47 g/mol
• Exact Mass: 404.20
• IUPAC Name: N-[3-cyclopropyl-1-[6-(2-oxa-7-azaspiro[3.4]octan-7-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide
• SMILES: CC(=O)Nc1cc2c(cn1)c(C1CC1)nn2-c1cccc(N2CCC3(COC3)C2)n1
• InChI: InChI=1S/C22H24N6O2/c1-14(29)24-18-9-17-16(10-23-18)21(15-5-6-15)26-28(17)20-4-2-3-19(25-20)27-8-7-22(11-27)12-30-13-22/h2-4,9-10,15H,5-8,11-13H2,1H3,(H,23,24,29)
• InChIKey: ZKVRACDDBSUXRL-UHFFFAOYSA-N
• XLogP: 2.88
• TPSA: 85.17 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 4
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	404.47
LogP ≤ 5	2.88
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[3-cyclopropyl-1-[6-(2-oxa-7-azaspiro[3.4]octan-7-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide?

The IUPAC name of N-[3-cyclopropyl-1-[6-(2-oxa-7-azaspiro[3.4]octan-7-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide (CID 170577482) is N-[3-cyclopropyl-1-[6-(2-oxa-7-azaspiro[3.4]octan-7-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide.

What is the SMILES notation for N-[3-cyclopropyl-1-[6-(2-oxa-7-azaspiro[3.4]octan-7-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide?

The canonical SMILES for N-[3-cyclopropyl-1-[6-(2-oxa-7-azaspiro[3.4]octan-7-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide is CC(=O)Nc1cc2c(cn1)c(C1CC1)nn2-c1cccc(N2CCC3(COC3)C2)n1.

What is the InChIKey of N-[3-cyclopropyl-1-[6-(2-oxa-7-azaspiro[3.4]octan-7-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide?

The InChIKey is ZKVRACDDBSUXRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N6O2/c1-14(29)24-18-9-17-16(10-23-18)21(15-5-6-15)26-28(17)20-4-2-3-19(25-20)27-8-7-22(11-27)12-30-13-22/h2-4,9-10,15H,5-8,11-13H2,1H3,(H,23,24,29).

What are the key properties of N-[3-cyclopropyl-1-[6-(2-oxa-7-azaspiro[3.4]octan-7-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide?

N-[3-cyclopropyl-1-[6-(2-oxa-7-azaspiro[3.4]octan-7-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide has a molecular weight of 404.47 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-cyclopropyl-1-[6-(2-oxa-7-azaspiro[3.4]octan-7-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide is sourced from PubChem (CID 170577482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).