N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate

C261H280N82O15+10 — CID 159418468

IUPACN-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate
SMILESCC(C)C(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.CC(C)NC(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.CC(C)OC(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.CN(C)C(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.COCC(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.C[C@@H](O)C(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.C[n+]1cc(-c2cc(-c3ccc(N4CCC(N5CCCC5=O)CC4)nc3)c3c(C#N)cnn3c2)c[nH]1.C[n+]1cc(-c2cc(-c3ccc(N4CCC(N5CC[C@H](O)C5=O)CC4)nc3)c3c(C#N)cnn3c2)c[nH]1.C[n+]1cc(-c2cc(-c3ccc(N4CCC(NC(=O)[C@@H]5CCCO5)CC4)nc3)c3c(C#N)cnn3c2)c[nH]1.C[n+]1cc(-c2cc(-c3ccc(N4CCC(NC(=O)c5ccccc5)CC4)nc3)c3c(C#N)cnn3c2)c[nH]1
InChIInChI=1S/C29H26N8O.C27H28N8O2.C26H29N9O.C26H26N8O2.C26H28N8O2.C26H26N8O.C26H28N8O.C25H27N9O.2C25H26N8O2/c1-35-18-24(17-32-35)22-13-26(28-23(14-30)16-33-37(28)19-22)21-7-8-27(31-15-21)36-11-9-25(10-12-36)34-29(38)20-5-3-2-4-6-20;1-33-16-21(15-30-33)19-11-23(26-20(12-28)14-31-35(26)17-19)18-4-5-25(29-13-18)34-8-6-22(7-9-34)32-27(36)24-3-2-10-37-24;1-17(2)31-26(36)32-22-6-8-34(9-7-22)24-5-4-18(12-28-24)23-10-19(21-14-29-33(3)15-21)16-35-25(23)20(11-27)13-30-35;1-31-15-20(14-29-31)18-10-22(25-19(11-27)13-30-34(25)16-18)17-2-3-24(28-12-17)32-7-4-21(5-8-32)33-9-6-23(35)26(33)36;1-17(2)36-26(35)31-22-6-8-33(9-7-22)24-5-4-18(12-28-24)23-10-19(21-14-29-32(3)15-21)16-34-25(23)20(11-27)13-30-34;1-31-16-21(15-29-31)19-11-23(26-20(12-27)14-30-34(26)17-19)18-4-5-24(28-13-18)32-9-6-22(7-10-32)33-8-2-3-25(33)35;1-17(2)26(35)31-22-6-8-33(9-7-22)24-5-4-18(12-28-24)23-10-19(21-14-29-32(3)15-21)16-34-25(23)20(11-27)13-30-34;1-31(2)25(35)30-21-6-8-33(9-7-21)23-5-4-17(12-27-23)22-10-18(20-14-28-32(3)15-20)16-34-24(22)19(11-26)13-29-34;1-31-14-20(13-28-31)18-9-22(25-19(10-26)12-29-33(25)15-18)17-3-4-23(27-11-17)32-7-5-21(6-8-32)30-24(34)16-35-2;1-16(34)25(35)30-21-5-7-32(8-6-21)23-4-3-17(11-27-23)22-9-18(20-13-28-31(2)14-20)15-33-24(22)19(10-26)12-29-33/h2-8,13,15-19,25H,9-12H2,1H3,(H,34,38);4-5,11,13-17,22,24H,2-3,6-10H2,1H3,(H,32,36);4-5,10,12-17,22H,6-9H2,1-3H3,(H2,31,32,36);2-3,10,12-16,21,23,35H,4-9H2,1H3;4-5,10,12-17,22H,6-9H2,1-3H3,(H,31,35);4-5,11,13-17,22H,2-3,6-10H2,1H3;4-5,10,12-17,22H,6-9H2,1-3H3,(H,31,35);4-5,10,12-16,21H,6-9H2,1-3H3,(H,30,35);3-4,9,11-15,21H,5-8,16H2,1-2H3,(H,30,34);3-4,9,11-16,21,34H,5-8H2,1-2H3,(H,30,35)/p+10/t;24-;;23-;;;;;;16-/m.0.0.....1/s1
InChIKeyIGLIGNUVUZZVQB-YXLDXLQKSA-X
MW4805.67 g/mol
LogP24.65
Rot. Bonds48

About N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate

N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate (PubChem CID 159418468) has the molecular formula C261H280N82O15+10 and a molecular weight of 4805.67 g/mol. Its IUPAC name is N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate.

Molecular Properties

Compound NameN-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate
PubChem CID159418468
Molecular FormulaC261H280N82O15+10
Molecular Weight4805.67 g/mol
Exact Mass4802.36
IUPAC NameN-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate
SMILESCC(C)C(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.CC(C)NC(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.CC(C)OC(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.CN(C)C(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.COCC(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.C[C@@H](O)C(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.C[n+]1cc(-c2cc(-c3ccc(N4CCC(N5CCCC5=O)CC4)nc3)c3c(C#N)cnn3c2)c[nH]1.C[n+]1cc(-c2cc(-c3ccc(N4CCC(N5CC[C@H](O)C5=O)CC4)nc3)c3c(C#N)cnn3c2)c[nH]1.C[n+]1cc(-c2cc(-c3ccc(N4CCC(NC(=O)[C@@H]5CCCO5)CC4)nc3)c3c(C#N)cnn3c2)c[nH]1.C[n+]1cc(-c2cc(-c3ccc(N4CCC(NC(=O)c5ccccc5)CC4)nc3)c3c(C#N)cnn3c2)c[nH]1
InChIInChI=1S/C29H26N8O.C27H28N8O2.C26H29N9O.C26H26N8O2.C26H28N8O2.C26H26N8O.C26H28N8O.C25H27N9O.2C25H26N8O2/c1-35-18-24(17-32-35)22-13-26(28-23(14-30)16-33-37(28)19-22)21-7-8-27(31-15-21)36-11-9-25(10-12-36)34-29(38)20-5-3-2-4-6-20;1-33-16-21(15-30-33)19-11-23(26-20(12-28)14-31-35(26)17-19)18-4-5-25(29-13-18)34-8-6-22(7-9-34)32-27(36)24-3-2-10-37-24;1-17(2)31-26(36)32-22-6-8-34(9-7-22)24-5-4-18(12-28-24)23-10-19(21-14-29-33(3)15-21)16-35-25(23)20(11-27)13-30-35;1-31-15-20(14-29-31)18-10-22(25-19(11-27)13-30-34(25)16-18)17-2-3-24(28-12-17)32-7-4-21(5-8-32)33-9-6-23(35)26(33)36;1-17(2)36-26(35)31-22-6-8-33(9-7-22)24-5-4-18(12-28-24)23-10-19(21-14-29-32(3)15-21)16-34-25(23)20(11-27)13-30-34;1-31-16-21(15-29-31)19-11-23(26-20(12-27)14-30-34(26)17-19)18-4-5-24(28-13-18)32-9-6-22(7-10-32)33-8-2-3-25(33)35;1-17(2)26(35)31-22-6-8-33(9-7-22)24-5-4-18(12-28-24)23-10-19(21-14-29-32(3)15-21)16-34-25(23)20(11-27)13-30-34;1-31(2)25(35)30-21-6-8-33(9-7-21)23-5-4-17(12-27-23)22-10-18(20-14-28-32(3)15-20)16-34-24(22)19(11-26)13-29-34;1-31-14-20(13-28-31)18-9-22(25-19(10-26)12-29-33(25)15-18)17-3-4-23(27-11-17)32-7-5-21(6-8-32)30-24(34)16-35-2;1-16(34)25(35)30-21-5-7-32(8-6-21)23-4-3-17(11-27-23)22-9-18(20-13-28-31(2)14-20)15-33-24(22)19(10-26)12-29-33/h2-8,13,15-19,25H,9-12H2,1H3,(H,34,38);4-5,11,13-17,22,24H,2-3,6-10H2,1H3,(H,32,36);4-5,10,12-17,22H,6-9H2,1-3H3,(H2,31,32,36);2-3,10,12-16,21,23,35H,4-9H2,1H3;4-5,10,12-17,22H,6-9H2,1-3H3,(H,31,35);4-5,11,13-17,22H,2-3,6-10H2,1H3;4-5,10,12-17,22H,6-9H2,1-3H3,(H,31,35);4-5,10,12-16,21H,6-9H2,1-3H3,(H,30,35);3-4,9,11-15,21H,5-8,16H2,1-2H3,(H,30,34);3-4,9,11-16,21,34H,5-8H2,1-2H3,(H,30,35)/p+10/t;24-;;23-;;;;;;16-/m.0.0.....1/s1
InChIKeyIGLIGNUVUZZVQB-YXLDXLQKSA-X
XLogP24.65
TPSA1125.74 Ų
H-Bond Donors21
H-Bond Acceptors65
Rotatable Bonds48
Heavy Atoms358
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004805.67
LogP ≤ 524.65
H-Bond Donors ≤ 521
H-Bond Acceptors ≤ 1065

Analyze N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate?
The IUPAC name of N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate (CID 159418468) is N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate.
What is the SMILES notation for N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate?
The canonical SMILES for N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate is CC(C)C(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.CC(C)NC(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.CC(C)OC(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.CN(C)C(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.COCC(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.C[C@@H](O)C(=O)NC1CCN(c2ccc(-c3cc(-c4c[nH][n+](C)c4)cn4ncc(C#N)c34)cn2)CC1.C[n+]1cc(-c2cc(-c3ccc(N4CCC(N5CCCC5=O)CC4)nc3)c3c(C#N)cnn3c2)c[nH]1.C[n+]1cc(-c2cc(-c3ccc(N4CCC(N5CC[C@H](O)C5=O)CC4)nc3)c3c(C#N)cnn3c2)c[nH]1.C[n+]1cc(-c2cc(-c3ccc(N4CCC(NC(=O)[C@@H]5CCCO5)CC4)nc3)c3c(C#N)cnn3c2)c[nH]1.C[n+]1cc(-c2cc(-c3ccc(N4CCC(NC(=O)c5ccccc5)CC4)nc3)c3c(C#N)cnn3c2)c[nH]1.
What is the InChIKey of N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate?
The InChIKey is IGLIGNUVUZZVQB-YXLDXLQKSA-X. The full InChI is InChI=1S/C29H26N8O.C27H28N8O2.C26H29N9O.C26H26N8O2.C26H28N8O2.C26H26N8O.C26H28N8O.C25H27N9O.2C25H26N8O2/c1-35-18-24(17-32-35)22-13-26(28-23(14-30)16-33-37(28)19-22)21-7-8-27(31-15-21)36-11-9-25(10-12-36)34-29(38)20-5-3-2-4-6-20;1-33-16-21(15-30-33)19-11-23(26-20(12-28)14-31-35(26)17-19)18-4-5-25(29-13-18)34-8-6-22(7-9-34)32-27(36)24-3-2-10-37-24;1-17(2)31-26(36)32-22-6-8-34(9-7-22)24-5-4-18(12-28-24)23-10-19(21-14-29-33(3)15-21)16-35-25(23)20(11-27)13-30-35;1-31-15-20(14-29-31)18-10-22(25-19(11-27)13-30-34(25)16-18)17-2-3-24(28-12-17)32-7-4-21(5-8-32)33-9-6-23(35)26(33)36;1-17(2)36-26(35)31-22-6-8-33(9-7-22)24-5-4-18(12-28-24)23-10-19(21-14-29-32(3)15-21)16-34-25(23)20(11-27)13-30-34;1-31-16-21(15-29-31)19-11-23(26-20(12-27)14-30-34(26)17-19)18-4-5-24(28-13-18)32-9-6-22(7-10-32)33-8-2-3-25(33)35;1-17(2)26(35)31-22-6-8-33(9-7-22)24-5-4-18(12-28-24)23-10-19(21-14-29-32(3)15-21)16-34-25(23)20(11-27)13-30-34;1-31(2)25(35)30-21-6-8-33(9-7-21)23-5-4-17(12-27-23)22-10-18(20-14-28-32(3)15-20)16-34-24(22)19(11-26)13-29-34;1-31-14-20(13-28-31)18-9-22(25-19(10-26)12-29-33(25)15-18)17-3-4-23(27-11-17)32-7-5-21(6-8-32)30-24(34)16-35-2;1-16(34)25(35)30-21-5-7-32(8-6-21)23-4-3-17(11-27-23)22-9-18(20-13-28-31(2)14-20)15-33-24(22)19(10-26)12-29-33/h2-8,13,15-19,25H,9-12H2,1H3,(H,34,38);4-5,11,13-17,22,24H,2-3,6-10H2,1H3,(H,32,36);4-5,10,12-17,22H,6-9H2,1-3H3,(H2,31,32,36);2-3,10,12-16,21,23,35H,4-9H2,1H3;4-5,10,12-17,22H,6-9H2,1-3H3,(H,31,35);4-5,11,13-17,22H,2-3,6-10H2,1H3;4-5,10,12-17,22H,6-9H2,1-3H3,(H,31,35);4-5,10,12-16,21H,6-9H2,1-3H3,(H,30,35);3-4,9,11-15,21H,5-8,16H2,1-2H3,(H,30,34);3-4,9,11-16,21,34H,5-8H2,1-2H3,(H,30,35)/p+10/t;24-;;23-;;;;;;16-/m.0.0.....1/s1.
What are the key properties of N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate?
N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate has a molecular weight of 4805.67 g/mol, XLogP of 24.65, 48 rotatable bonds, 21 hydrogen bond donors, and 65 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]benzamide;3-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-1,1-dimethylurea;(2R)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-hydroxypropanamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methoxyacetamide;N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-2-methylpropanamide;(2S)-N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]oxolane-2-carboxamide;1-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]-3-propan-2-ylurea;4-[6-[4-[(3S)-3-hydroxy-2-oxopyrrolidin-1-yl]piperidin-1-yl]-3-pyridinyl]-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;6-(2-methyl-1H-pyrazol-2-ium-4-yl)-4-[6-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;propan-2-yl N-[1-[5-[3-cyano-6-(2-methyl-1H-pyrazol-2-ium-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]piperidin-4-yl]carbamate is sourced from PubChem (CID 159418468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).