4-[3-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-methylsulfonylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;4-[3-[4-[1-(2-fluoroethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide

C103H102FN21O6S — CID 157151756

About 4-[3-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-methylsulfonylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;4-[3-[4-[1-(2-fluoroethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide

4-[3-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-methylsulfonylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;4-[3-[4-[1-(2-fluoroethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide (PubChem CID 157151756) has the molecular formula C103H102FN21O6S and a molecular weight of 1781.15 g/mol. Its IUPAC name is 4-[3-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-methylsulfonylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;4-[3-[4-[1-(2-fluoroethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide.

Molecular Properties

• Compound Name: 4-[3-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-methylsulfonylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;4-[3-[4-[1-(2-fluoroethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide
• PubChem CID: 157151756
• Molecular Formula: C103H102FN21O6S
• Molecular Weight: 1781.15 g/mol
• Exact Mass: 1779.80
• IUPAC Name: 4-[3-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-methylsulfonylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;4-[3-[4-[1-(2-fluoroethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide
• SMILES: CC(C)(C#Cc1cccn2ncc(-c3ccc(-c4cnn(CC5CC5)c4)cc3)c12)C(N)=O.CC(C)(C#Cc1cccn2ncc(-c3ccc(-c4cnn(CCF)c4)cc3)c12)C(N)=O.CC(C)(C#Cc1cccn2ncc(-c3ccc(-c4cnn(CCN5CCCC5)c4)cc3)c12)C(N)=O.CC(C)(C#Cc1cccn2ncc(-c3ccc(-c4cnn(CCS(C)(=O)=O)c4)cc3)c12)C(N)=O
• InChI: InChI=1S/C28H30N6O.C26H25N5O.C25H25N5O3S.C24H22FN5O/c1-28(2,27(29)35)12-11-23-6-5-15-34-26(23)25(19-31-34)22-9-7-21(8-10-22)24-18-30-33(20-24)17-16-32-13-3-4-14-32;1-26(2,25(27)32)12-11-21-4-3-13-31-24(21)23(15-29-31)20-9-7-19(8-10-20)22-14-28-30(17-22)16-18-5-6-18;1-25(2,24(26)31)11-10-20-5-4-12-30-23(20)22(16-28-30)19-8-6-18(7-9-19)21-15-27-29(17-21)13-14-34(3,32)33;1-24(2,23(26)31)10-9-19-4-3-12-30-22(19)21(15-28-30)18-7-5-17(6-8-18)20-14-27-29(16-20)13-11-25/h5-10,15,18-20H,3-4,13-14,16-17H2,1-2H3,(H2,29,35);3-4,7-10,13-15,17-18H,5-6,16H2,1-2H3,(H2,27,32);4-9,12,15-17H,13-14H2,1-3H3,(H2,26,31);3-8,12,14-16H,11,13H2,1-2H3,(H2,26,31)
• InChIKey: ALIJZYSKBBVMBO-UHFFFAOYSA-N
• XLogP: 14.43
• TPSA: 350.22 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 23
• Rotatable Bonds: 22
• Heavy Atoms: 132
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1781.15
LogP ≤ 5	14.43
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-[3-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-methylsulfonylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;4-[3-[4-[1-(2-fluoroethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide?

The IUPAC name of 4-[3-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-methylsulfonylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;4-[3-[4-[1-(2-fluoroethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide (CID 157151756) is 4-[3-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-methylsulfonylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;4-[3-[4-[1-(2-fluoroethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide.

What is the SMILES notation for 4-[3-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-methylsulfonylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;4-[3-[4-[1-(2-fluoroethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide?

The canonical SMILES for 4-[3-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-methylsulfonylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;4-[3-[4-[1-(2-fluoroethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide is CC(C)(C#Cc1cccn2ncc(-c3ccc(-c4cnn(CC5CC5)c4)cc3)c12)C(N)=O.CC(C)(C#Cc1cccn2ncc(-c3ccc(-c4cnn(CCF)c4)cc3)c12)C(N)=O.CC(C)(C#Cc1cccn2ncc(-c3ccc(-c4cnn(CCN5CCCC5)c4)cc3)c12)C(N)=O.CC(C)(C#Cc1cccn2ncc(-c3ccc(-c4cnn(CCS(C)(=O)=O)c4)cc3)c12)C(N)=O.

What is the InChIKey of 4-[3-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-methylsulfonylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;4-[3-[4-[1-(2-fluoroethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide?

The InChIKey is ALIJZYSKBBVMBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H30N6O.C26H25N5O.C25H25N5O3S.C24H22FN5O/c1-28(2,27(29)35)12-11-23-6-5-15-34-26(23)25(19-31-34)22-9-7-21(8-10-22)24-18-30-33(20-24)17-16-32-13-3-4-14-32;1-26(2,25(27)32)12-11-21-4-3-13-31-24(21)23(15-29-31)20-9-7-19(8-10-20)22-14-28-30(17-22)16-18-5-6-18;1-25(2,24(26)31)11-10-20-5-4-12-30-23(20)22(16-28-30)19-8-6-18(7-9-19)21-15-27-29(17-21)13-14-34(3,32)33;1-24(2,23(26)31)10-9-19-4-3-12-30-22(19)21(15-28-30)18-7-5-17(6-8-18)20-14-27-29(16-20)13-11-25/h5-10,15,18-20H,3-4,13-14,16-17H2,1-2H3,(H2,29,35);3-4,7-10,13-15,17-18H,5-6,16H2,1-2H3,(H2,27,32);4-9,12,15-17H,13-14H2,1-3H3,(H2,26,31);3-8,12,14-16H,11,13H2,1-2H3,(H2,26,31).

What are the key properties of 4-[3-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-methylsulfonylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;4-[3-[4-[1-(2-fluoroethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide?

4-[3-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-methylsulfonylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;4-[3-[4-[1-(2-fluoroethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide has a molecular weight of 1781.15 g/mol, XLogP of 14.43, 22 rotatable bonds, 4 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[3-[4-[1-(cyclopropylmethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-methylsulfonylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;4-[3-[4-[1-(2-fluoroethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]-2,2-dimethylbut-3-ynamide is sourced from PubChem (CID 157151756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).