N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide

C22H22N8O3S — CID 171656565

About N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide

N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 171656565) has the molecular formula C22H22N8O3S and a molecular weight of 478.54 g/mol. Its IUPAC name is N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
• PubChem CID: 171656565
• Molecular Formula: C22H22N8O3S
• Molecular Weight: 478.54 g/mol
• Exact Mass: 478.15
• IUPAC Name: N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
• SMILES: Cc1ccc(-n2nnc(C3CN(S(=O)(=O)C4CC4)C3)n2)cc1NC(=O)c1cnn2ccccc12
• InChI: InChI=1S/C22H22N8O3S/c1-14-5-6-16(10-19(14)24-22(31)18-11-23-29-9-3-2-4-20(18)29)30-26-21(25-27-30)15-12-28(13-15)34(32,33)17-7-8-17/h2-6,9-11,15,17H,7-8,12-13H2,1H3,(H,24,31)
• InChIKey: FLBGEBUCJHAACA-UHFFFAOYSA-N
• XLogP: 1.76
• TPSA: 127.38 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 9
• Rotatable Bonds: 6
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	478.54
LogP ≤ 5	1.76
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?

The IUPAC name of N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 171656565) is N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide.

What is the SMILES notation for N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?

The canonical SMILES for N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide is Cc1ccc(-n2nnc(C3CN(S(=O)(=O)C4CC4)C3)n2)cc1NC(=O)c1cnn2ccccc12.

What is the InChIKey of N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?

The InChIKey is FLBGEBUCJHAACA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N8O3S/c1-14-5-6-16(10-19(14)24-22(31)18-11-23-29-9-3-2-4-20(18)29)30-26-21(25-27-30)15-12-28(13-15)34(32,33)17-7-8-17/h2-6,9-11,15,17H,7-8,12-13H2,1H3,(H,24,31).

What are the key properties of N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?

N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 478.54 g/mol, XLogP of 1.76, 6 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 171656565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).