N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-2-cyclopropyl-4-methylpiperidin-4-yl]prop-2-ynamide;N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-ethoxypiperidin-4-yl]prop-2-ynamide;N-[8-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl]prop-2-ynamide

C80H84N18O7 — CID 164988137

About N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-2-cyclopropyl-4-methylpiperidin-4-yl]prop-2-ynamide;N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-ethoxypiperidin-4-yl]prop-2-ynamide;N-[8-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl]prop-2-ynamide

N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-2-cyclopropyl-4-methylpiperidin-4-yl]prop-2-ynamide;N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-ethoxypiperidin-4-yl]prop-2-ynamide;N-[8-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl]prop-2-ynamide (PubChem CID 164988137) has the molecular formula C80H84N18O7 and a molecular weight of 1409.67 g/mol. Its IUPAC name is N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-2-cyclopropyl-4-methylpiperidin-4-yl]prop-2-ynamide;N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-ethoxypiperidin-4-yl]prop-2-ynamide;N-[8-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl]prop-2-ynamide.

Molecular Properties

• Compound Name: N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-2-cyclopropyl-4-methylpiperidin-4-yl]prop-2-ynamide;N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-ethoxypiperidin-4-yl]prop-2-ynamide;N-[8-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl]prop-2-ynamide
• PubChem CID: 164988137
• Molecular Formula: C80H84N18O7
• Molecular Weight: 1409.67 g/mol
• Exact Mass: 1408.68
• IUPAC Name: N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-2-cyclopropyl-4-methylpiperidin-4-yl]prop-2-ynamide;N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-ethoxypiperidin-4-yl]prop-2-ynamide;N-[8-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl]prop-2-ynamide
• SMILES: C#CC(=O)NC1(C(C)C)CC2CCC(C1)N2c1ccc(-c2cc(OCC)cn3ncc(C#N)c23)cn1.C#CC(=O)NC1(C)CCN(c2ccc(-c3cc(OCC)cn4ncc(C#N)c34)cn2)C(C2CC2)C1.C#CC(=O)NC1CCN(c2ccc(-c3cc(OCC)cn4ncc(C#N)c34)cn2)CC1OCC
• InChI: InChI=1S/C28H30N6O2.C27H28N6O2.C25H26N6O3/c1-5-26(35)32-28(18(3)4)12-21-8-9-22(13-28)34(21)25-10-7-19(15-30-25)24-11-23(36-6-2)17-33-27(24)20(14-29)16-31-33;1-4-25(34)31-27(3)10-11-32(23(13-27)18-6-7-18)24-9-8-19(15-29-24)22-12-21(35-5-2)17-33-26(22)20(14-28)16-30-33;1-4-24(32)29-21-9-10-30(16-22(21)34-6-3)23-8-7-17(13-27-23)20-11-19(33-5-2)15-31-25(20)18(12-26)14-28-31/h1,7,10-11,15-18,21-22H,6,8-9,12-13H2,2-4H3,(H,32,35);1,8-9,12,15-18,23H,5-7,10-11,13H2,2-3H3,(H,31,34);1,7-8,11,13-15,21-22H,5-6,9-10,16H2,2-3H3,(H,29,32)
• InChIKey: GLQRULRGQYNEHW-UHFFFAOYSA-N
• XLogP: 9.90
• TPSA: 295.88 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 22
• Rotatable Bonds: 19
• Heavy Atoms: 105
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1409.67
LogP ≤ 5	9.90
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-2-cyclopropyl-4-methylpiperidin-4-yl]prop-2-ynamide;N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-ethoxypiperidin-4-yl]prop-2-ynamide;N-[8-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl]prop-2-ynamide?

The IUPAC name of N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-2-cyclopropyl-4-methylpiperidin-4-yl]prop-2-ynamide;N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-ethoxypiperidin-4-yl]prop-2-ynamide;N-[8-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl]prop-2-ynamide (CID 164988137) is N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-2-cyclopropyl-4-methylpiperidin-4-yl]prop-2-ynamide;N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-ethoxypiperidin-4-yl]prop-2-ynamide;N-[8-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl]prop-2-ynamide.

What is the SMILES notation for N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-2-cyclopropyl-4-methylpiperidin-4-yl]prop-2-ynamide;N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-ethoxypiperidin-4-yl]prop-2-ynamide;N-[8-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl]prop-2-ynamide?

The canonical SMILES for N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-2-cyclopropyl-4-methylpiperidin-4-yl]prop-2-ynamide;N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-ethoxypiperidin-4-yl]prop-2-ynamide;N-[8-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl]prop-2-ynamide is C#CC(=O)NC1(C(C)C)CC2CCC(C1)N2c1ccc(-c2cc(OCC)cn3ncc(C#N)c23)cn1.C#CC(=O)NC1(C)CCN(c2ccc(-c3cc(OCC)cn4ncc(C#N)c34)cn2)C(C2CC2)C1.C#CC(=O)NC1CCN(c2ccc(-c3cc(OCC)cn4ncc(C#N)c34)cn2)CC1OCC.

What is the InChIKey of N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-2-cyclopropyl-4-methylpiperidin-4-yl]prop-2-ynamide;N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-ethoxypiperidin-4-yl]prop-2-ynamide;N-[8-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl]prop-2-ynamide?

The InChIKey is GLQRULRGQYNEHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H30N6O2.C27H28N6O2.C25H26N6O3/c1-5-26(35)32-28(18(3)4)12-21-8-9-22(13-28)34(21)25-10-7-19(15-30-25)24-11-23(36-6-2)17-33-27(24)20(14-29)16-31-33;1-4-25(34)31-27(3)10-11-32(23(13-27)18-6-7-18)24-9-8-19(15-29-24)22-12-21(35-5-2)17-33-26(22)20(14-28)16-30-33;1-4-24(32)29-21-9-10-30(16-22(21)34-6-3)23-8-7-17(13-27-23)20-11-19(33-5-2)15-31-25(20)18(12-26)14-28-31/h1,7,10-11,15-18,21-22H,6,8-9,12-13H2,2-4H3,(H,32,35);1,8-9,12,15-18,23H,5-7,10-11,13H2,2-3H3,(H,31,34);1,7-8,11,13-15,21-22H,5-6,9-10,16H2,2-3H3,(H,29,32).

What are the key properties of N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-2-cyclopropyl-4-methylpiperidin-4-yl]prop-2-ynamide;N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-ethoxypiperidin-4-yl]prop-2-ynamide;N-[8-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl]prop-2-ynamide?

N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-2-cyclopropyl-4-methylpiperidin-4-yl]prop-2-ynamide;N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-ethoxypiperidin-4-yl]prop-2-ynamide;N-[8-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl]prop-2-ynamide has a molecular weight of 1409.67 g/mol, XLogP of 9.90, 19 rotatable bonds, 3 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-2-cyclopropyl-4-methylpiperidin-4-yl]prop-2-ynamide;N-[1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-ethoxypiperidin-4-yl]prop-2-ynamide;N-[8-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-3-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl]prop-2-ynamide is sourced from PubChem (CID 164988137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).