N-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide

C97H91N15O15 — CID 158225235

IUPACN-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide
SMILESCOc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4ccccc4)c(OC)c23)cc1.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4cccnc4)c(OC)c23)cc1.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4ccoc4)c(OC)c23)cc1OC.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4cnccn4)c(OC)c23)cc1OC
InChIInChI=1S/C25H23N3O3.C24H23N5O4.C24H22N4O3.C24H23N3O5/c1-30-19-11-8-17(9-12-19)10-14-21-23-22(28-27-21)15-13-20(24(23)31-2)25(29)26-16-18-6-4-3-5-7-18;1-31-20-9-5-15(12-21(20)32-2)4-7-18-22-19(29-28-18)8-6-17(23(22)33-3)24(30)27-14-16-13-25-10-11-26-16;1-30-18-8-5-16(6-9-18)7-11-20-22-21(28-27-20)12-10-19(23(22)31-2)24(29)26-15-17-4-3-13-25-14-17;1-29-20-9-5-15(12-21(20)30-2)4-7-18-22-19(27-26-18)8-6-17(23(22)31-3)24(28)25-13-16-10-11-32-14-16/h3-15H,16H2,1-2H3,(H,26,29)(H,27,28);4-13H,14H2,1-3H3,(H,27,30)(H,28,29);3-14H,15H2,1-2H3,(H,26,29)(H,27,28);4-12,14H,13H2,1-3H3,(H,25,28)(H,26,27)/b14-10+;7-4+;11-7+;7-4+
InChIKeyGDSGFNBIRNHTIH-QZDOKBHASA-N
MW1706.88 g/mol
LogP16.52
Rot. Bonds30

About N-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide

N-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide (PubChem CID 158225235) has the molecular formula C97H91N15O15 and a molecular weight of 1706.88 g/mol. Its IUPAC name is N-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide.

Molecular Properties

Compound NameN-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide
PubChem CID158225235
Molecular FormulaC97H91N15O15
Molecular Weight1706.88 g/mol
Exact Mass1705.68
IUPAC NameN-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide
SMILESCOc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4ccccc4)c(OC)c23)cc1.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4cccnc4)c(OC)c23)cc1.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4ccoc4)c(OC)c23)cc1OC.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4cnccn4)c(OC)c23)cc1OC
InChIInChI=1S/C25H23N3O3.C24H23N5O4.C24H22N4O3.C24H23N3O5/c1-30-19-11-8-17(9-12-19)10-14-21-23-22(28-27-21)15-13-20(24(23)31-2)25(29)26-16-18-6-4-3-5-7-18;1-31-20-9-5-15(12-21(20)32-2)4-7-18-22-19(29-28-18)8-6-17(23(22)33-3)24(30)27-14-16-13-25-10-11-26-16;1-30-18-8-5-16(6-9-18)7-11-20-22-21(28-27-20)12-10-19(23(22)31-2)24(29)26-15-17-4-3-13-25-14-17;1-29-20-9-5-15(12-21(20)30-2)4-7-18-22-19(27-26-18)8-6-17(23(22)31-3)24(28)25-13-16-10-11-32-14-16/h3-15H,16H2,1-2H3,(H,26,29)(H,27,28);4-13H,14H2,1-3H3,(H,27,30)(H,28,29);3-14H,15H2,1-2H3,(H,26,29)(H,27,28);4-12,14H,13H2,1-3H3,(H,25,28)(H,26,27)/b14-10+;7-4+;11-7+;7-4+
InChIKeyGDSGFNBIRNHTIH-QZDOKBHASA-N
XLogP16.52
TPSA375.23 Ų
H-Bond Donors8
H-Bond Acceptors22
Rotatable Bonds30
Heavy Atoms127
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001706.88
LogP ≤ 516.52
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1022

Analyze N-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide?
The IUPAC name of N-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide (CID 158225235) is N-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide.
What is the SMILES notation for N-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide?
The canonical SMILES for N-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide is COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4ccccc4)c(OC)c23)cc1.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4cccnc4)c(OC)c23)cc1.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4ccoc4)c(OC)c23)cc1OC.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4cnccn4)c(OC)c23)cc1OC.
What is the InChIKey of N-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide?
The InChIKey is GDSGFNBIRNHTIH-QZDOKBHASA-N. The full InChI is InChI=1S/C25H23N3O3.C24H23N5O4.C24H22N4O3.C24H23N3O5/c1-30-19-11-8-17(9-12-19)10-14-21-23-22(28-27-21)15-13-20(24(23)31-2)25(29)26-16-18-6-4-3-5-7-18;1-31-20-9-5-15(12-21(20)32-2)4-7-18-22-19(29-28-18)8-6-17(23(22)33-3)24(30)27-14-16-13-25-10-11-26-16;1-30-18-8-5-16(6-9-18)7-11-20-22-21(28-27-20)12-10-19(23(22)31-2)24(29)26-15-17-4-3-13-25-14-17;1-29-20-9-5-15(12-21(20)30-2)4-7-18-22-19(27-26-18)8-6-17(23(22)31-3)24(28)25-13-16-10-11-32-14-16/h3-15H,16H2,1-2H3,(H,26,29)(H,27,28);4-13H,14H2,1-3H3,(H,27,30)(H,28,29);3-14H,15H2,1-2H3,(H,26,29)(H,27,28);4-12,14H,13H2,1-3H3,(H,25,28)(H,26,27)/b14-10+;7-4+;11-7+;7-4+.
What are the key properties of N-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide?
N-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide has a molecular weight of 1706.88 g/mol, XLogP of 16.52, 30 rotatable bonds, 8 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-N-(furan-3-ylmethyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(pyrazin-2-ylmethyl)-2H-indazole-5-carboxamide;4-methoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide is sourced from PubChem (CID 158225235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).