benzyl N-[4-[4-(4-cyanopiperidin-1-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]carbamate;1-[3-[4-(morpholine-4-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-(4-piperidin-1-ylsulfonylphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile

C126H135N25O8S — CID 161167546

About benzyl N-[4-[4-(4-cyanopiperidin-1-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]carbamate;1-[3-[4-(morpholine-4-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-(4-piperidin-1-ylsulfonylphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile

benzyl N-[4-[4-(4-cyanopiperidin-1-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]carbamate;1-[3-[4-(morpholine-4-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-(4-piperidin-1-ylsulfonylphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile (PubChem CID 161167546) has the molecular formula C126H135N25O8S and a molecular weight of 2159.70 g/mol. Its IUPAC name is benzyl N-[4-[4-(4-cyanopiperidin-1-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]carbamate;1-[3-[4-(morpholine-4-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-(4-piperidin-1-ylsulfonylphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile.

Molecular Properties

• Compound Name: benzyl N-[4-[4-(4-cyanopiperidin-1-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]carbamate;1-[3-[4-(morpholine-4-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-(4-piperidin-1-ylsulfonylphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile
• PubChem CID: 161167546
• Molecular Formula: C126H135N25O8S
• Molecular Weight: 2159.70 g/mol
• Exact Mass: 2158.06
• IUPAC Name: benzyl N-[4-[4-(4-cyanopiperidin-1-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]carbamate;1-[3-[4-(morpholine-4-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-(4-piperidin-1-ylsulfonylphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile
• SMILES: N#CC1CCN(c2cccn3ncc(-c4ccc(C(=O)N5CCCC5)cc4)c23)CC1.N#CC1CCN(c2cccn3ncc(-c4ccc(C(=O)N5CCOCC5)cc4)c23)CC1.N#CC1CCN(c2cccn3ncc(-c4ccc(NC(=O)OCc5ccccc5)cc4)c23)CC1.N#CC1CCN(c2cccn3ncc(-c4ccc(OCCCN5CCCCC5)cc4)c23)CC1.N#CC1CCN(c2cccn3ncc(-c4ccc(S(=O)(=O)N5CCCCC5)cc4)c23)CC1
• InChI: InChI=1S/C27H25N5O2.C27H33N5O.C24H27N5O2S.C24H25N5O2.C24H25N5O/c28-17-20-12-15-31(16-13-20)25-7-4-14-32-26(25)24(18-29-32)22-8-10-23(11-9-22)30-27(33)34-19-21-5-2-1-3-6-21;28-20-22-11-17-31(18-12-22)26-6-4-16-32-27(26)25(21-29-32)23-7-9-24(10-8-23)33-19-5-15-30-13-2-1-3-14-30;25-17-19-10-15-27(16-11-19)23-5-4-14-29-24(23)22(18-26-29)20-6-8-21(9-7-20)32(30,31)28-12-2-1-3-13-28;25-16-18-7-10-27(11-8-18)22-2-1-9-29-23(22)21(17-26-29)19-3-5-20(6-4-19)24(30)28-12-14-31-15-13-28;25-16-18-9-14-27(15-10-18)22-4-3-13-29-23(22)21(17-26-29)19-5-7-20(8-6-19)24(30)28-11-1-2-12-28/h1-11,14,18,20H,12-13,15-16,19H2,(H,30,33);4,6-10,16,21-22H,1-3,5,11-15,17-19H2;4-9,14,18-19H,1-3,10-13,15-16H2;1-6,9,17-18H,7-8,10-15H2;3-8,13,17-18H,1-2,9-12,14-15H2
• InChIKey: UQTBCYAINKOMJR-UHFFFAOYSA-N
• XLogP: 21.59
• TPSA: 359.68 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 29
• Rotatable Bonds: 22
• Heavy Atoms: 160
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2159.70
LogP ≤ 5	21.59
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of benzyl N-[4-[4-(4-cyanopiperidin-1-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]carbamate;1-[3-[4-(morpholine-4-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-(4-piperidin-1-ylsulfonylphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile?

The IUPAC name of benzyl N-[4-[4-(4-cyanopiperidin-1-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]carbamate;1-[3-[4-(morpholine-4-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-(4-piperidin-1-ylsulfonylphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile (CID 161167546) is benzyl N-[4-[4-(4-cyanopiperidin-1-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]carbamate;1-[3-[4-(morpholine-4-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-(4-piperidin-1-ylsulfonylphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile.

What is the SMILES notation for benzyl N-[4-[4-(4-cyanopiperidin-1-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]carbamate;1-[3-[4-(morpholine-4-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-(4-piperidin-1-ylsulfonylphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile?

The canonical SMILES for benzyl N-[4-[4-(4-cyanopiperidin-1-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]carbamate;1-[3-[4-(morpholine-4-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-(4-piperidin-1-ylsulfonylphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile is N#CC1CCN(c2cccn3ncc(-c4ccc(C(=O)N5CCCC5)cc4)c23)CC1.N#CC1CCN(c2cccn3ncc(-c4ccc(C(=O)N5CCOCC5)cc4)c23)CC1.N#CC1CCN(c2cccn3ncc(-c4ccc(NC(=O)OCc5ccccc5)cc4)c23)CC1.N#CC1CCN(c2cccn3ncc(-c4ccc(OCCCN5CCCCC5)cc4)c23)CC1.N#CC1CCN(c2cccn3ncc(-c4ccc(S(=O)(=O)N5CCCCC5)cc4)c23)CC1.

What is the InChIKey of benzyl N-[4-[4-(4-cyanopiperidin-1-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]carbamate;1-[3-[4-(morpholine-4-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-(4-piperidin-1-ylsulfonylphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile?

The InChIKey is UQTBCYAINKOMJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H25N5O2.C27H33N5O.C24H27N5O2S.C24H25N5O2.C24H25N5O/c28-17-20-12-15-31(16-13-20)25-7-4-14-32-26(25)24(18-29-32)22-8-10-23(11-9-22)30-27(33)34-19-21-5-2-1-3-6-21;28-20-22-11-17-31(18-12-22)26-6-4-16-32-27(26)25(21-29-32)23-7-9-24(10-8-23)33-19-5-15-30-13-2-1-3-14-30;25-17-19-10-15-27(16-11-19)23-5-4-14-29-24(23)22(18-26-29)20-6-8-21(9-7-20)32(30,31)28-12-2-1-3-13-28;25-16-18-7-10-27(11-8-18)22-2-1-9-29-23(22)21(17-26-29)19-3-5-20(6-4-19)24(30)28-12-14-31-15-13-28;25-16-18-9-14-27(15-10-18)22-4-3-13-29-23(22)21(17-26-29)19-5-7-20(8-6-19)24(30)28-11-1-2-12-28/h1-11,14,18,20H,12-13,15-16,19H2,(H,30,33);4,6-10,16,21-22H,1-3,5,11-15,17-19H2;4-9,14,18-19H,1-3,10-13,15-16H2;1-6,9,17-18H,7-8,10-15H2;3-8,13,17-18H,1-2,9-12,14-15H2.

What are the key properties of benzyl N-[4-[4-(4-cyanopiperidin-1-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]carbamate;1-[3-[4-(morpholine-4-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-(4-piperidin-1-ylsulfonylphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile?

benzyl N-[4-[4-(4-cyanopiperidin-1-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]carbamate;1-[3-[4-(morpholine-4-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-(4-piperidin-1-ylsulfonylphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile has a molecular weight of 2159.70 g/mol, XLogP of 21.59, 22 rotatable bonds, 1 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for benzyl N-[4-[4-(4-cyanopiperidin-1-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]carbamate;1-[3-[4-(morpholine-4-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-(4-piperidin-1-ylsulfonylphenyl)pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;1-[3-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile is sourced from PubChem (CID 161167546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).