4-[3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl]-N-[(6-methoxy-3-pyridinyl)methyl]pyrazole-1-carboxamide;hydrochloride

C23H24ClN7O4 — CID 162752735

About 4-[3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl]-N-[(6-methoxy-3-pyridinyl)methyl]pyrazole-1-carboxamide;hydrochloride

4-[3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl]-N-[(6-methoxy-3-pyridinyl)methyl]pyrazole-1-carboxamide;hydrochloride (PubChem CID 162752735) has the molecular formula C23H24ClN7O4 and a molecular weight of 497.94 g/mol. Its IUPAC name is 4-[3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl]-N-[(6-methoxy-3-pyridinyl)methyl]pyrazole-1-carboxamide;hydrochloride.

Molecular Properties

• Compound Name: 4-[3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl]-N-[(6-methoxy-3-pyridinyl)methyl]pyrazole-1-carboxamide;hydrochloride
• PubChem CID: 162752735
• Molecular Formula: C23H24ClN7O4
• Molecular Weight: 497.94 g/mol
• Exact Mass: 497.16
• IUPAC Name: 4-[3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl]-N-[(6-methoxy-3-pyridinyl)methyl]pyrazole-1-carboxamide;hydrochloride
• SMILES: COc1ccc(CNC(=O)n2cc(-c3cc(OCC(C)(C)O)cn4ncc(C#N)c34)cn2)cn1.Cl
• InChI: InChI=1S/C23H23N7O4.ClH/c1-23(2,32)14-34-18-6-19(21-16(7-24)10-27-29(21)13-18)17-11-28-30(12-17)22(31)26-9-15-4-5-20(33-3)25-8-15;/h4-6,8,10-13,32H,9,14H2,1-3H3,(H,26,31);1H
• InChIKey: RYLFFLMUVIAMPX-UHFFFAOYSA-N
• XLogP: 2.80
• TPSA: 139.59 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 10
• Rotatable Bonds: 7
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	497.94
LogP ≤ 5	2.80
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	10

Frequently Asked Questions

What is the IUPAC name of 4-[3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl]-N-[(6-methoxy-3-pyridinyl)methyl]pyrazole-1-carboxamide;hydrochloride?

The IUPAC name of 4-[3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl]-N-[(6-methoxy-3-pyridinyl)methyl]pyrazole-1-carboxamide;hydrochloride (CID 162752735) is 4-[3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl]-N-[(6-methoxy-3-pyridinyl)methyl]pyrazole-1-carboxamide;hydrochloride.

What is the SMILES notation for 4-[3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl]-N-[(6-methoxy-3-pyridinyl)methyl]pyrazole-1-carboxamide;hydrochloride?

The canonical SMILES for 4-[3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl]-N-[(6-methoxy-3-pyridinyl)methyl]pyrazole-1-carboxamide;hydrochloride is COc1ccc(CNC(=O)n2cc(-c3cc(OCC(C)(C)O)cn4ncc(C#N)c34)cn2)cn1.Cl.

What is the InChIKey of 4-[3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl]-N-[(6-methoxy-3-pyridinyl)methyl]pyrazole-1-carboxamide;hydrochloride?

The InChIKey is RYLFFLMUVIAMPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N7O4.ClH/c1-23(2,32)14-34-18-6-19(21-16(7-24)10-27-29(21)13-18)17-11-28-30(12-17)22(31)26-9-15-4-5-20(33-3)25-8-15;/h4-6,8,10-13,32H,9,14H2,1-3H3,(H,26,31);1H.

What are the key properties of 4-[3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl]-N-[(6-methoxy-3-pyridinyl)methyl]pyrazole-1-carboxamide;hydrochloride?

4-[3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl]-N-[(6-methoxy-3-pyridinyl)methyl]pyrazole-1-carboxamide;hydrochloride has a molecular weight of 497.94 g/mol, XLogP of 2.80, 7 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl]-N-[(6-methoxy-3-pyridinyl)methyl]pyrazole-1-carboxamide;hydrochloride is sourced from PubChem (CID 162752735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).