3-[[5-chloro-1-(cyclohexylmethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-chloro-1-(2-cyclopentylethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(cyclohexylmethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(2-cyclopentylethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[(1-cyclopropyl-5-methylindazol-3-yl)methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(oxolan-3-yl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(3,3,3-trifluoropropyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid

C141H136Cl2F5N21O15 — CID 160890382

About 3-[[5-chloro-1-(cyclohexylmethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-chloro-1-(2-cyclopentylethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(cyclohexylmethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(2-cyclopentylethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[(1-cyclopropyl-5-methylindazol-3-yl)methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(oxolan-3-yl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(3,3,3-trifluoropropyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid

3-[[5-chloro-1-(cyclohexylmethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-chloro-1-(2-cyclopentylethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(cyclohexylmethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(2-cyclopentylethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[(1-cyclopropyl-5-methylindazol-3-yl)methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(oxolan-3-yl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(3,3,3-trifluoropropyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid (PubChem CID 160890382) has the molecular formula C141H136Cl2F5N21O15 and a molecular weight of 2530.67 g/mol. Its IUPAC name is 3-[[5-chloro-1-(cyclohexylmethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-chloro-1-(2-cyclopentylethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(cyclohexylmethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(2-cyclopentylethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[(1-cyclopropyl-5-methylindazol-3-yl)methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(oxolan-3-yl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(3,3,3-trifluoropropyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid.

Molecular Properties

• Compound Name: 3-[[5-chloro-1-(cyclohexylmethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-chloro-1-(2-cyclopentylethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(cyclohexylmethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(2-cyclopentylethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[(1-cyclopropyl-5-methylindazol-3-yl)methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(oxolan-3-yl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(3,3,3-trifluoropropyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid
• PubChem CID: 160890382
• Molecular Formula: C141H136Cl2F5N21O15
• Molecular Weight: 2530.67 g/mol
• Exact Mass: 2527.98
• IUPAC Name: 3-[[5-chloro-1-(cyclohexylmethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-chloro-1-(2-cyclopentylethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(cyclohexylmethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(2-cyclopentylethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[(1-cyclopropyl-5-methylindazol-3-yl)methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(oxolan-3-yl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(3,3,3-trifluoropropyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid
• SMILES: C#Cc1ccc2c(c1)c(Cc1cnccc1C(=O)O)nn2C1CCOC1.C#Cc1ccc2c(c1)c(Cc1cnccc1C(=O)O)nn2CCC(F)(F)F.Cc1ccc2c(c1)c(Cc1cnccc1C(=O)O)nn2C1CC1.O=C(O)c1ccncc1Cc1nn(CC2CCCCC2)c2ccc(Cl)cc12.O=C(O)c1ccncc1Cc1nn(CC2CCCCC2)c2ccc(F)cc12.O=C(O)c1ccncc1Cc1nn(CCC2CCCC2)c2ccc(Cl)cc12.O=C(O)c1ccncc1Cc1nn(CCC2CCCC2)c2ccc(F)cc12
• InChI: InChI=1S/2C21H22ClN3O2.2C21H22FN3O2.C20H17N3O3.C19H14F3N3O2.C18H17N3O2/c22-16-5-6-20-18(12-16)19(11-15-13-23-9-7-17(15)21(26)27)24-25(20)10-8-14-3-1-2-4-14;22-16-6-7-20-18(11-16)19(10-15-12-23-9-8-17(15)21(26)27)24-25(20)13-14-4-2-1-3-5-14;22-16-5-6-20-18(12-16)19(11-15-13-23-9-7-17(15)21(26)27)24-25(20)10-8-14-3-1-2-4-14;22-16-6-7-20-18(11-16)19(10-15-12-23-9-8-17(15)21(26)27)24-25(20)13-14-4-2-1-3-5-14;1-2-13-3-4-19-17(9-13)18(22-23(19)15-6-8-26-12-15)10-14-11-21-7-5-16(14)20(24)25;1-2-12-3-4-17-15(9-12)16(24-25(17)8-6-19(20,21)22)10-13-11-23-7-5-14(13)18(26)27;1-11-2-5-17-15(8-11)16(20-21(17)13-3-4-13)9-12-10-19-7-6-14(12)18(22)23/h5-7,9,12-14H,1-4,8,10-11H2,(H,26,27);6-9,11-12,14H,1-5,10,13H2,(H,26,27);5-7,9,12-14H,1-4,8,10-11H2,(H,26,27);6-9,11-12,14H,1-5,10,13H2,(H,26,27);1,3-5,7,9,11,15H,6,8,10,12H2,(H,24,25);1,3-5,7,9,11H,6,8,10H2,(H,26,27);2,5-8,10,13H,3-4,9H2,1H3,(H,22,23)
• InChIKey: SOEOTBQLRKCREO-UHFFFAOYSA-N
• XLogP: 28.47
• TPSA: 485.30 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 29
• Rotatable Bonds: 35
• Heavy Atoms: 184
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2530.67
LogP ≤ 5	28.47
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-[[5-chloro-1-(cyclohexylmethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-chloro-1-(2-cyclopentylethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(cyclohexylmethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(2-cyclopentylethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[(1-cyclopropyl-5-methylindazol-3-yl)methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(oxolan-3-yl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(3,3,3-trifluoropropyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid?

The IUPAC name of 3-[[5-chloro-1-(cyclohexylmethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-chloro-1-(2-cyclopentylethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(cyclohexylmethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(2-cyclopentylethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[(1-cyclopropyl-5-methylindazol-3-yl)methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(oxolan-3-yl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(3,3,3-trifluoropropyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid (CID 160890382) is 3-[[5-chloro-1-(cyclohexylmethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-chloro-1-(2-cyclopentylethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(cyclohexylmethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(2-cyclopentylethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[(1-cyclopropyl-5-methylindazol-3-yl)methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(oxolan-3-yl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(3,3,3-trifluoropropyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid.

What is the SMILES notation for 3-[[5-chloro-1-(cyclohexylmethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-chloro-1-(2-cyclopentylethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(cyclohexylmethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(2-cyclopentylethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[(1-cyclopropyl-5-methylindazol-3-yl)methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(oxolan-3-yl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(3,3,3-trifluoropropyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid?

The canonical SMILES for 3-[[5-chloro-1-(cyclohexylmethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-chloro-1-(2-cyclopentylethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(cyclohexylmethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(2-cyclopentylethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[(1-cyclopropyl-5-methylindazol-3-yl)methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(oxolan-3-yl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(3,3,3-trifluoropropyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid is C#Cc1ccc2c(c1)c(Cc1cnccc1C(=O)O)nn2C1CCOC1.C#Cc1ccc2c(c1)c(Cc1cnccc1C(=O)O)nn2CCC(F)(F)F.Cc1ccc2c(c1)c(Cc1cnccc1C(=O)O)nn2C1CC1.O=C(O)c1ccncc1Cc1nn(CC2CCCCC2)c2ccc(Cl)cc12.O=C(O)c1ccncc1Cc1nn(CC2CCCCC2)c2ccc(F)cc12.O=C(O)c1ccncc1Cc1nn(CCC2CCCC2)c2ccc(Cl)cc12.O=C(O)c1ccncc1Cc1nn(CCC2CCCC2)c2ccc(F)cc12.

What is the InChIKey of 3-[[5-chloro-1-(cyclohexylmethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-chloro-1-(2-cyclopentylethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(cyclohexylmethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(2-cyclopentylethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[(1-cyclopropyl-5-methylindazol-3-yl)methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(oxolan-3-yl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(3,3,3-trifluoropropyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid?

The InChIKey is SOEOTBQLRKCREO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C21H22ClN3O2.2C21H22FN3O2.C20H17N3O3.C19H14F3N3O2.C18H17N3O2/c22-16-5-6-20-18(12-16)19(11-15-13-23-9-7-17(15)21(26)27)24-25(20)10-8-14-3-1-2-4-14;22-16-6-7-20-18(11-16)19(10-15-12-23-9-8-17(15)21(26)27)24-25(20)13-14-4-2-1-3-5-14;22-16-5-6-20-18(12-16)19(11-15-13-23-9-7-17(15)21(26)27)24-25(20)10-8-14-3-1-2-4-14;22-16-6-7-20-18(11-16)19(10-15-12-23-9-8-17(15)21(26)27)24-25(20)13-14-4-2-1-3-5-14;1-2-13-3-4-19-17(9-13)18(22-23(19)15-6-8-26-12-15)10-14-11-21-7-5-16(14)20(24)25;1-2-12-3-4-17-15(9-12)16(24-25(17)8-6-19(20,21)22)10-13-11-23-7-5-14(13)18(26)27;1-11-2-5-17-15(8-11)16(20-21(17)13-3-4-13)9-12-10-19-7-6-14(12)18(22)23/h5-7,9,12-14H,1-4,8,10-11H2,(H,26,27);6-9,11-12,14H,1-5,10,13H2,(H,26,27);5-7,9,12-14H,1-4,8,10-11H2,(H,26,27);6-9,11-12,14H,1-5,10,13H2,(H,26,27);1,3-5,7,9,11,15H,6,8,10,12H2,(H,24,25);1,3-5,7,9,11H,6,8,10H2,(H,26,27);2,5-8,10,13H,3-4,9H2,1H3,(H,22,23).

What are the key properties of 3-[[5-chloro-1-(cyclohexylmethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-chloro-1-(2-cyclopentylethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(cyclohexylmethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(2-cyclopentylethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[(1-cyclopropyl-5-methylindazol-3-yl)methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(oxolan-3-yl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(3,3,3-trifluoropropyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid?

3-[[5-chloro-1-(cyclohexylmethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-chloro-1-(2-cyclopentylethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(cyclohexylmethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(2-cyclopentylethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[(1-cyclopropyl-5-methylindazol-3-yl)methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(oxolan-3-yl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(3,3,3-trifluoropropyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid has a molecular weight of 2530.67 g/mol, XLogP of 28.47, 35 rotatable bonds, 7 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[[5-chloro-1-(cyclohexylmethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-chloro-1-(2-cyclopentylethyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(cyclohexylmethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[1-(2-cyclopentylethyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[(1-cyclopropyl-5-methylindazol-3-yl)methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(oxolan-3-yl)indazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-ethynyl-1-(3,3,3-trifluoropropyl)indazol-3-yl]methyl]pyridine-4-carboxylic acid is sourced from PubChem (CID 160890382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).