5-(4-cyanopiperidin-1-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carbonitrile;4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxythiane 1,1-dioxide;1-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(thian-4-yloxy)imidazo[1,2-a]pyridine;1-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile

C114H103F6N27O4S2 — CID 162238733

About 5-(4-cyanopiperidin-1-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carbonitrile;4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxythiane 1,1-dioxide;1-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(thian-4-yloxy)imidazo[1,2-a]pyridine;1-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile

5-(4-cyanopiperidin-1-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carbonitrile;4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxythiane 1,1-dioxide;1-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(thian-4-yloxy)imidazo[1,2-a]pyridine;1-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile (PubChem CID 162238733) has the molecular formula C114H103F6N27O4S2 and a molecular weight of 2093.38 g/mol. Its IUPAC name is 5-(4-cyanopiperidin-1-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carbonitrile;4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxythiane 1,1-dioxide;1-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(thian-4-yloxy)imidazo[1,2-a]pyridine;1-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile.

Molecular Properties

• Compound Name: 5-(4-cyanopiperidin-1-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carbonitrile;4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxythiane 1,1-dioxide;1-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(thian-4-yloxy)imidazo[1,2-a]pyridine;1-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile
• PubChem CID: 162238733
• Molecular Formula: C114H103F6N27O4S2
• Molecular Weight: 2093.38 g/mol
• Exact Mass: 2091.80
• IUPAC Name: 5-(4-cyanopiperidin-1-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carbonitrile;4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxythiane 1,1-dioxide;1-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(thian-4-yloxy)imidazo[1,2-a]pyridine;1-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile
• SMILES: Cn1cc(-c2ccc(-c3cnc4ccc(C#N)c(N5CCC(C#N)CC5)n34)cc2)cn1.Cn1cc(-c2ccc(-c3cnn4cccc(N5CCC(C#N)CC5)c34)cc2)cn1.FC(F)n1cc(-c2ccc(-c3cnc4cccc(OC5CCSCC5)n34)cc2)cn1.N#CC1CCN(c2cccn3ncc(-c4ccc(-c5cnn(C(F)F)c5)cc4)c23)CC1.O=S1(=O)CCC(Oc2cccc3ncc(-c4ccc(-c5cnn(C(F)F)c5)cc4)n23)CC1
• InChI: InChI=1S/C24H21N7.C23H20F2N6.C23H22N6.C22H20F2N4O3S.C22H20F2N4OS/c1-29-16-21(14-28-29)18-2-4-19(5-3-18)22-15-27-23-7-6-20(13-26)24(31(22)23)30-10-8-17(12-25)9-11-30;24-23(25)31-15-19(13-27-31)17-3-5-18(6-4-17)20-14-28-30-9-1-2-21(22(20)30)29-10-7-16(12-26)8-11-29;1-27-16-20(14-25-27)18-4-6-19(7-5-18)21-15-26-29-10-2-3-22(23(21)29)28-11-8-17(13-24)9-12-28;23-22(24)27-14-17(12-26-27)15-4-6-16(7-5-15)19-13-25-20-2-1-3-21(28(19)20)31-18-8-10-32(29,30)11-9-18;23-22(24)27-14-17(12-26-27)15-4-6-16(7-5-15)19-13-25-20-2-1-3-21(28(19)20)29-18-8-10-30-11-9-18/h2-7,14-17H,8-11H2,1H3;1-6,9,13-16,23H,7-8,10-11H2;2-7,10,14-17H,8-9,11-12H2,1H3;1-7,12-14,18,22H,8-11H2;1-7,12-14,18,22H,8-11H2
• InChIKey: ZWKMKUTWRFSHFH-UHFFFAOYSA-N
• XLogP: 22.91
• TPSA: 333.08 Ų
• H-Bond Acceptors: 32
• Rotatable Bonds: 20
• Heavy Atoms: 153
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2093.38
LogP ≤ 5	22.91
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of 5-(4-cyanopiperidin-1-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carbonitrile;4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxythiane 1,1-dioxide;1-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(thian-4-yloxy)imidazo[1,2-a]pyridine;1-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile?

The IUPAC name of 5-(4-cyanopiperidin-1-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carbonitrile;4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxythiane 1,1-dioxide;1-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(thian-4-yloxy)imidazo[1,2-a]pyridine;1-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile (CID 162238733) is 5-(4-cyanopiperidin-1-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carbonitrile;4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxythiane 1,1-dioxide;1-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(thian-4-yloxy)imidazo[1,2-a]pyridine;1-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile.

What is the SMILES notation for 5-(4-cyanopiperidin-1-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carbonitrile;4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxythiane 1,1-dioxide;1-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(thian-4-yloxy)imidazo[1,2-a]pyridine;1-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile?

The canonical SMILES for 5-(4-cyanopiperidin-1-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carbonitrile;4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxythiane 1,1-dioxide;1-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(thian-4-yloxy)imidazo[1,2-a]pyridine;1-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile is Cn1cc(-c2ccc(-c3cnc4ccc(C#N)c(N5CCC(C#N)CC5)n34)cc2)cn1.Cn1cc(-c2ccc(-c3cnn4cccc(N5CCC(C#N)CC5)c34)cc2)cn1.FC(F)n1cc(-c2ccc(-c3cnc4cccc(OC5CCSCC5)n34)cc2)cn1.N#CC1CCN(c2cccn3ncc(-c4ccc(-c5cnn(C(F)F)c5)cc4)c23)CC1.O=S1(=O)CCC(Oc2cccc3ncc(-c4ccc(-c5cnn(C(F)F)c5)cc4)n23)CC1.

What is the InChIKey of 5-(4-cyanopiperidin-1-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carbonitrile;4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxythiane 1,1-dioxide;1-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(thian-4-yloxy)imidazo[1,2-a]pyridine;1-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile?

The InChIKey is ZWKMKUTWRFSHFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N7.C23H20F2N6.C23H22N6.C22H20F2N4O3S.C22H20F2N4OS/c1-29-16-21(14-28-29)18-2-4-19(5-3-18)22-15-27-23-7-6-20(13-26)24(31(22)23)30-10-8-17(12-25)9-11-30;24-23(25)31-15-19(13-27-31)17-3-5-18(6-4-17)20-14-28-30-9-1-2-21(22(20)30)29-10-7-16(12-26)8-11-29;1-27-16-20(14-25-27)18-4-6-19(7-5-18)21-15-26-29-10-2-3-22(23(21)29)28-11-8-17(13-24)9-12-28;23-22(24)27-14-17(12-26-27)15-4-6-16(7-5-15)19-13-25-20-2-1-3-21(28(19)20)31-18-8-10-32(29,30)11-9-18;23-22(24)27-14-17(12-26-27)15-4-6-16(7-5-15)19-13-25-20-2-1-3-21(28(19)20)29-18-8-10-30-11-9-18/h2-7,14-17H,8-11H2,1H3;1-6,9,13-16,23H,7-8,10-11H2;2-7,10,14-17H,8-9,11-12H2,1H3;1-7,12-14,18,22H,8-11H2;1-7,12-14,18,22H,8-11H2.

What are the key properties of 5-(4-cyanopiperidin-1-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carbonitrile;4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxythiane 1,1-dioxide;1-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(thian-4-yloxy)imidazo[1,2-a]pyridine;1-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile?

5-(4-cyanopiperidin-1-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carbonitrile;4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxythiane 1,1-dioxide;1-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(thian-4-yloxy)imidazo[1,2-a]pyridine;1-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile has a molecular weight of 2093.38 g/mol, XLogP of 22.91, 20 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(4-cyanopiperidin-1-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridine-6-carbonitrile;4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxythiane 1,1-dioxide;1-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(thian-4-yloxy)imidazo[1,2-a]pyridine;1-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]piperidine-4-carbonitrile is sourced from PubChem (CID 162238733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).