N-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide

C95H96N12O16S — CID 158089701

IUPACN-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide
SMILESCOc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NC4CC4)c(OC)c23)cc1OC.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCC4CC4)c(OC)c23)cc1OC.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4ccccc4)c(OC)c23)cc1OC.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4cccs4)c(OC)c23)cc1OC
InChIInChI=1S/C26H25N3O4.C24H23N3O4S.C23H25N3O4.C22H23N3O4/c1-31-22-14-10-17(15-23(22)32-2)9-12-20-24-21(29-28-20)13-11-19(25(24)33-3)26(30)27-16-18-7-5-4-6-8-18;1-29-20-11-7-15(13-21(20)30-2)6-9-18-22-19(27-26-18)10-8-17(23(22)31-3)24(28)25-14-16-5-4-12-32-16;1-28-19-11-7-14(12-20(19)29-2)6-9-17-21-18(26-25-17)10-8-16(22(21)30-3)23(27)24-13-15-4-5-15;1-27-18-11-5-13(12-19(18)28-2)4-9-16-20-17(25-24-16)10-8-15(21(20)29-3)22(26)23-14-6-7-14/h4-15H,16H2,1-3H3,(H,27,30)(H,28,29);4-13H,14H2,1-3H3,(H,25,28)(H,26,27);6-12,15H,4-5,13H2,1-3H3,(H,24,27)(H,25,26);4-5,8-12,14H,6-7H2,1-3H3,(H,23,26)(H,24,25)/b12-9+;2*9-6+;9-4+
InChIKeyFNYHPVVSVOHMGK-AEKWWBSJSA-N
MW1693.95 g/mol
LogP16.99
Rot. Bonds31

About N-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide

N-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide (PubChem CID 158089701) has the molecular formula C95H96N12O16S and a molecular weight of 1693.95 g/mol. Its IUPAC name is N-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide.

Molecular Properties

Compound NameN-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide
PubChem CID158089701
Molecular FormulaC95H96N12O16S
Molecular Weight1693.95 g/mol
Exact Mass1692.68
IUPAC NameN-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide
SMILESCOc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NC4CC4)c(OC)c23)cc1OC.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCC4CC4)c(OC)c23)cc1OC.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4ccccc4)c(OC)c23)cc1OC.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4cccs4)c(OC)c23)cc1OC
InChIInChI=1S/C26H25N3O4.C24H23N3O4S.C23H25N3O4.C22H23N3O4/c1-31-22-14-10-17(15-23(22)32-2)9-12-20-24-21(29-28-20)13-11-19(25(24)33-3)26(30)27-16-18-7-5-4-6-8-18;1-29-20-11-7-15(13-21(20)30-2)6-9-18-22-19(27-26-18)10-8-17(23(22)31-3)24(28)25-14-16-5-4-12-32-16;1-28-19-11-7-14(12-20(19)29-2)6-9-17-21-18(26-25-17)10-8-16(22(21)30-3)23(27)24-13-15-4-5-15;1-27-18-11-5-13(12-19(18)28-2)4-9-16-20-17(25-24-16)10-8-15(21(20)29-3)22(26)23-14-6-7-14/h4-15H,16H2,1-3H3,(H,27,30)(H,28,29);4-13H,14H2,1-3H3,(H,25,28)(H,26,27);6-12,15H,4-5,13H2,1-3H3,(H,24,27)(H,25,26);4-5,8-12,14H,6-7H2,1-3H3,(H,23,26)(H,24,25)/b12-9+;2*9-6+;9-4+
InChIKeyFNYHPVVSVOHMGK-AEKWWBSJSA-N
XLogP16.99
TPSA341.88 Ų
H-Bond Donors8
H-Bond Acceptors21
Rotatable Bonds31
Heavy Atoms124
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001693.95
LogP ≤ 516.99
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1021

Analyze N-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(1-benzothiophen-2-yl)-4-methoxy-N-[(3-methoxyphenyl)methyl]-1H-indazole-5-carboxamide
CID 23589754
3-(1-benzothiophen-2-yl)-6-methoxy-N-(thiophen-2-ylmethyl)-1H-indazole-5-carboxamide
CID 23589764
3-(1-benzothiophen-2-yl)-N-cyclopropyl-6-methoxy-1H-indazole-5-carboxamide
CID 23589779
3-(1-benzothiophen-2-yl)-N-(cyclopropylmethyl)-6-methoxy-1H-indazole-5-carboxamide
CID 23589781
3-[(E)-2-(2,3-dihydro-1-benzofuran-5-yl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-1H-indazole-5-carboxamide
CID 60034928
3-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-1H-indazole-5-carboxamide
CID 60034944
3-[(E)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-1H-indazole-5-carboxamide
CID 60053862
4-methoxy-3-[2-(4-methoxyphenyl)ethenyl]-N-(thiophen-2-ylmethyl)-1H-indazole-5-carboxamide
CID 72628205
3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-1H-indazole-5-carboxamide
CID 72628235
3-[2-(1,3-benzodioxol-5-yl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-1H-indazole-5-carboxamide
CID 72628243
3-[2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-1H-indazole-5-carboxamide
CID 72628317
3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-1H-indazole-5-carboxamide
CID 72635842

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide?
The IUPAC name of N-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide (CID 158089701) is N-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide.
What is the SMILES notation for N-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide?
The canonical SMILES for N-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide is COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NC4CC4)c(OC)c23)cc1OC.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCC4CC4)c(OC)c23)cc1OC.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4ccccc4)c(OC)c23)cc1OC.COc1ccc(/C=C/c2[nH]nc3ccc(C(=O)NCc4cccs4)c(OC)c23)cc1OC.
What is the InChIKey of N-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide?
The InChIKey is FNYHPVVSVOHMGK-AEKWWBSJSA-N. The full InChI is InChI=1S/C26H25N3O4.C24H23N3O4S.C23H25N3O4.C22H23N3O4/c1-31-22-14-10-17(15-23(22)32-2)9-12-20-24-21(29-28-20)13-11-19(25(24)33-3)26(30)27-16-18-7-5-4-6-8-18;1-29-20-11-7-15(13-21(20)30-2)6-9-18-22-19(27-26-18)10-8-17(23(22)31-3)24(28)25-14-16-5-4-12-32-16;1-28-19-11-7-14(12-20(19)29-2)6-9-17-21-18(26-25-17)10-8-16(22(21)30-3)23(27)24-13-15-4-5-15;1-27-18-11-5-13(12-19(18)28-2)4-9-16-20-17(25-24-16)10-8-15(21(20)29-3)22(26)23-14-6-7-14/h4-15H,16H2,1-3H3,(H,27,30)(H,28,29);4-13H,14H2,1-3H3,(H,25,28)(H,26,27);6-12,15H,4-5,13H2,1-3H3,(H,24,27)(H,25,26);4-5,8-12,14H,6-7H2,1-3H3,(H,23,26)(H,24,25)/b12-9+;2*9-6+;9-4+.
What are the key properties of N-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide?
N-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide has a molecular weight of 1693.95 g/mol, XLogP of 16.99, 31 rotatable bonds, 8 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methoxy-N-(thiophen-2-ylmethyl)-2H-indazole-5-carboxamide is sourced from PubChem (CID 158089701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).