5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide

C115H100F4N24O8 — CID 161414174

IUPAC5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
SMILESCc1ccc(Oc2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(CN6CCC(F)(F)C6)c5)cc34)cn2)cc1.Cc1ccc(Oc2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(CN6CCC(F)(F)CC6)c5)cc34)cn2)cc1.Cc1ccc(Oc2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(N)c5)cc34)cn2)cc1.Cc1ccc(Oc2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(N6CCCC6)c5)cc34)cn2)cc1
InChIInChI=1S/C31H28F2N6O2.C30H26F2N6O2.C29H26N6O2.C25H20N6O2/c1-20-2-6-25(7-3-20)41-28-9-5-24(18-35-28)36-30(40)29-26-15-22(4-8-27(26)37-38-29)23-14-21(16-34-17-23)19-39-12-10-31(32,33)11-13-39;1-19-2-6-24(7-3-19)40-27-9-5-23(16-34-27)35-29(39)28-25-13-21(4-8-26(25)36-37-28)22-12-20(14-33-15-22)17-38-11-10-30(31,32)18-38;1-19-4-8-24(9-5-19)37-27-11-7-22(17-31-27)32-29(36)28-25-15-20(6-10-26(25)33-34-28)21-14-23(18-30-16-21)35-12-2-3-13-35;1-15-2-6-20(7-3-15)33-23-9-5-19(14-28-23)29-25(32)24-21-11-16(4-8-22(21)30-31-24)17-10-18(26)13-27-12-17/h2-9,14-18H,10-13,19H2,1H3,(H,36,40)(H,37,38);2-9,12-16H,10-11,17-18H2,1H3,(H,35,39)(H,36,37);4-11,14-18H,2-3,12-13H2,1H3,(H,32,36)(H,33,34);2-14H,26H2,1H3,(H,29,32)(H,30,31)
InChIKeyVVVYIMPCONUODE-UHFFFAOYSA-N
MW2022.22 g/mol
LogP23.75
Rot. Bonds25

About 5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide

5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide (PubChem CID 161414174) has the molecular formula C115H100F4N24O8 and a molecular weight of 2022.22 g/mol. Its IUPAC name is 5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
PubChem CID161414174
Molecular FormulaC115H100F4N24O8
Molecular Weight2022.22 g/mol
Exact Mass2020.81
IUPAC Name5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
SMILESCc1ccc(Oc2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(CN6CCC(F)(F)C6)c5)cc34)cn2)cc1.Cc1ccc(Oc2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(CN6CCC(F)(F)CC6)c5)cc34)cn2)cc1.Cc1ccc(Oc2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(N)c5)cc34)cn2)cc1.Cc1ccc(Oc2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(N6CCCC6)c5)cc34)cn2)cc1
InChIInChI=1S/C31H28F2N6O2.C30H26F2N6O2.C29H26N6O2.C25H20N6O2/c1-20-2-6-25(7-3-20)41-28-9-5-24(18-35-28)36-30(40)29-26-15-22(4-8-27(26)37-38-29)23-14-21(16-34-17-23)19-39-12-10-31(32,33)11-13-39;1-19-2-6-24(7-3-19)40-27-9-5-23(16-34-27)35-29(39)28-25-13-21(4-8-26(25)36-37-28)22-12-20(14-33-15-22)17-38-11-10-30(31,32)18-38;1-19-4-8-24(9-5-19)37-27-11-7-22(17-31-27)32-29(36)28-25-15-20(6-10-26(25)33-34-28)21-14-23(18-30-16-21)35-12-2-3-13-35;1-15-2-6-20(7-3-15)33-23-9-5-19(14-28-23)29-25(32)24-21-11-16(4-8-22(21)30-31-24)17-10-18(26)13-27-12-17/h2-9,14-18H,10-13,19H2,1H3,(H,36,40)(H,37,38);2-9,12-16H,10-11,17-18H2,1H3,(H,35,39)(H,36,37);4-11,14-18H,2-3,12-13H2,1H3,(H,32,36)(H,33,34);2-14H,26H2,1H3,(H,29,32)(H,30,31)
InChIKeyVVVYIMPCONUODE-UHFFFAOYSA-N
XLogP23.75
TPSA406.90 Ų
H-Bond Donors9
H-Bond Acceptors24
Rotatable Bonds25
Heavy Atoms151
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002022.22
LogP ≤ 523.75
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1024

Analyze 5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide?
The IUPAC name of 5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide (CID 161414174) is 5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide?
The canonical SMILES for 5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide is Cc1ccc(Oc2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(CN6CCC(F)(F)C6)c5)cc34)cn2)cc1.Cc1ccc(Oc2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(CN6CCC(F)(F)CC6)c5)cc34)cn2)cc1.Cc1ccc(Oc2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(N)c5)cc34)cn2)cc1.Cc1ccc(Oc2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(N6CCCC6)c5)cc34)cn2)cc1.
What is the InChIKey of 5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide?
The InChIKey is VVVYIMPCONUODE-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H28F2N6O2.C30H26F2N6O2.C29H26N6O2.C25H20N6O2/c1-20-2-6-25(7-3-20)41-28-9-5-24(18-35-28)36-30(40)29-26-15-22(4-8-27(26)37-38-29)23-14-21(16-34-17-23)19-39-12-10-31(32,33)11-13-39;1-19-2-6-24(7-3-19)40-27-9-5-23(16-34-27)35-29(39)28-25-13-21(4-8-26(25)36-37-28)22-12-20(14-33-15-22)17-38-11-10-30(31,32)18-38;1-19-4-8-24(9-5-19)37-27-11-7-22(17-31-27)32-29(36)28-25-15-20(6-10-26(25)33-34-28)21-14-23(18-30-16-21)35-12-2-3-13-35;1-15-2-6-20(7-3-15)33-23-9-5-19(14-28-23)29-25(32)24-21-11-16(4-8-22(21)30-31-24)17-10-18(26)13-27-12-17/h2-9,14-18H,10-13,19H2,1H3,(H,36,40)(H,37,38);2-9,12-16H,10-11,17-18H2,1H3,(H,35,39)(H,36,37);4-11,14-18H,2-3,12-13H2,1H3,(H,32,36)(H,33,34);2-14H,26H2,1H3,(H,29,32)(H,30,31).
What are the key properties of 5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide?
5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide has a molecular weight of 2022.22 g/mol, XLogP of 23.75, 25 rotatable bonds, 9 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-amino-3-pyridinyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 161414174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).