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

C112H89F10N17O10S — CID 158132911

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

N-benzyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-2-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(thiophen-3-ylmethyl)-2H-indazole-5-carboxamide (PubChem CID 158132911) has the molecular formula C112H89F10N17O10S and a molecular weight of 2055.10 g/mol. Its IUPAC name is N-benzyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-2-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(thiophen-3-ylmethyl)-2H-indazole-5-carboxamide.

Molecular Properties

• Compound Name: N-benzyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-2-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(thiophen-3-ylmethyl)-2H-indazole-5-carboxamide
• PubChem CID: 158132911
• Molecular Formula: C112H89F10N17O10S
• Molecular Weight: 2055.10 g/mol
• Exact Mass: 2053.65
• IUPAC Name: N-benzyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-2-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(thiophen-3-ylmethyl)-2H-indazole-5-carboxamide
• SMILES: COc1c(C(=O)NC2CC2)ccc2n[nH]c(/C=C/c3ccc(F)cc3F)c12.COc1c(C(=O)NCc2ccccc2)ccc2n[nH]c(/C=C/c3ccc(F)cc3F)c12.COc1c(C(=O)NCc2ccccn2)ccc2n[nH]c(/C=C/c3ccc(F)cc3F)c12.COc1c(C(=O)NCc2cccnc2)ccc2n[nH]c(/C=C/c3ccc(F)cc3F)c12.COc1c(C(=O)NCc2ccsc2)ccc2n[nH]c(/C=C/c3ccc(F)cc3F)c12
• InChI: InChI=1S/C24H19F2N3O2.2C23H18F2N4O2.C22H17F2N3O2S.C20H17F2N3O2/c1-31-23-18(24(30)27-14-15-5-3-2-4-6-15)10-12-21-22(23)20(28-29-21)11-8-16-7-9-17(25)13-19(16)26;1-31-22-17(23(30)27-13-14-3-2-10-26-12-14)7-9-20-21(22)19(28-29-20)8-5-15-4-6-16(24)11-18(15)25;1-31-22-17(23(30)27-13-16-4-2-3-11-26-16)8-10-20-21(22)19(28-29-20)9-6-14-5-7-15(24)12-18(14)25;1-29-21-16(22(28)25-11-13-8-9-30-12-13)5-7-19-20(21)18(26-27-19)6-3-14-2-4-15(23)10-17(14)24;1-27-19-14(20(26)23-13-5-6-13)7-9-17-18(19)16(24-25-17)8-3-11-2-4-12(21)10-15(11)22/h2-13H,14H2,1H3,(H,27,30)(H,28,29);2*2-12H,13H2,1H3,(H,27,30)(H,28,29);2-10,12H,11H2,1H3,(H,25,28)(H,26,27);2-4,7-10,13H,5-6H2,1H3,(H,23,26)(H,24,25)/b11-8+;8-5+;9-6+;6-3+;8-3+
• InChIKey: FSZOYVRAXWOHNB-PDNCKSKRSA-N
• XLogP: 22.56
• TPSA: 360.83 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 18
• Rotatable Bonds: 29
• Heavy Atoms: 150
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2055.10
LogP ≤ 5	22.56
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-2-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(thiophen-3-ylmethyl)-2H-indazole-5-carboxamide?

The IUPAC name of N-benzyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-2-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(thiophen-3-ylmethyl)-2H-indazole-5-carboxamide (CID 158132911) is N-benzyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-2-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(thiophen-3-ylmethyl)-2H-indazole-5-carboxamide.

What is the SMILES notation for N-benzyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-2-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(thiophen-3-ylmethyl)-2H-indazole-5-carboxamide?

The canonical SMILES for N-benzyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-2-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(thiophen-3-ylmethyl)-2H-indazole-5-carboxamide is COc1c(C(=O)NC2CC2)ccc2n[nH]c(/C=C/c3ccc(F)cc3F)c12.COc1c(C(=O)NCc2ccccc2)ccc2n[nH]c(/C=C/c3ccc(F)cc3F)c12.COc1c(C(=O)NCc2ccccn2)ccc2n[nH]c(/C=C/c3ccc(F)cc3F)c12.COc1c(C(=O)NCc2cccnc2)ccc2n[nH]c(/C=C/c3ccc(F)cc3F)c12.COc1c(C(=O)NCc2ccsc2)ccc2n[nH]c(/C=C/c3ccc(F)cc3F)c12.

What is the InChIKey of N-benzyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-2-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(thiophen-3-ylmethyl)-2H-indazole-5-carboxamide?

The InChIKey is FSZOYVRAXWOHNB-PDNCKSKRSA-N. The full InChI is InChI=1S/C24H19F2N3O2.2C23H18F2N4O2.C22H17F2N3O2S.C20H17F2N3O2/c1-31-23-18(24(30)27-14-15-5-3-2-4-6-15)10-12-21-22(23)20(28-29-21)11-8-16-7-9-17(25)13-19(16)26;1-31-22-17(23(30)27-13-14-3-2-10-26-12-14)7-9-20-21(22)19(28-29-20)8-5-15-4-6-16(24)11-18(15)25;1-31-22-17(23(30)27-13-16-4-2-3-11-26-16)8-10-20-21(22)19(28-29-20)9-6-14-5-7-15(24)12-18(14)25;1-29-21-16(22(28)25-11-13-8-9-30-12-13)5-7-19-20(21)18(26-27-19)6-3-14-2-4-15(23)10-17(14)24;1-27-19-14(20(26)23-13-5-6-13)7-9-17-18(19)16(24-25-17)8-3-11-2-4-12(21)10-15(11)22/h2-13H,14H2,1H3,(H,27,30)(H,28,29);2*2-12H,13H2,1H3,(H,27,30)(H,28,29);2-10,12H,11H2,1H3,(H,25,28)(H,26,27);2-4,7-10,13H,5-6H2,1H3,(H,23,26)(H,24,25)/b11-8+;8-5+;9-6+;6-3+;8-3+.

What are the key properties of N-benzyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-2-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(thiophen-3-ylmethyl)-2H-indazole-5-carboxamide?

N-benzyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-2-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(thiophen-3-ylmethyl)-2H-indazole-5-carboxamide has a molecular weight of 2055.10 g/mol, XLogP of 22.56, 29 rotatable bonds, 10 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for N-benzyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-cyclopropyl-3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-2-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(pyridin-3-ylmethyl)-2H-indazole-5-carboxamide;3-[(E)-2-(2,4-difluorophenyl)ethenyl]-4-methoxy-N-(thiophen-3-ylmethyl)-2H-indazole-5-carboxamide is sourced from PubChem (CID 158132911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).