N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid

C93H81F5N14O11 — CID 158255496

IUPACN-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid
SMILESCOc1c(C#N)ccc2[nH]nc(/C=C/c3cccc(F)c3)c12.COc1c(C(=O)NC2CC2)ccc2n[nH]c(/C=C/c3cccc(F)c3)c12.COc1c(C(=O)N[C@H](CO)C(C)C)ccc2n[nH]c(/C=C/c3cccc(F)c3)c12.COc1c(C(=O)O)ccc2n[nH]c(/C=C/c3cccc(F)c3)c12.COc1c(C(N)=O)ccc2n[nH]c(/C=C/c3cccc(F)c3)c12
InChIInChI=1S/C22H24FN3O3.C20H18FN3O2.C17H14FN3O2.C17H12FN3O.C17H13FN2O3/c1-13(2)19(12-27)24-22(28)16-8-10-18-20(21(16)29-3)17(25-26-18)9-7-14-5-4-6-15(23)11-14;1-26-19-15(20(25)22-14-6-7-14)8-10-17-18(19)16(23-24-17)9-5-12-3-2-4-13(21)11-12;1-23-16-12(17(19)22)6-8-14-15(16)13(20-21-14)7-5-10-3-2-4-11(18)9-10;1-22-17-12(10-19)6-8-15-16(17)14(20-21-15)7-5-11-3-2-4-13(18)9-11;1-23-16-12(17(21)22)6-8-14-15(16)13(19-20-14)7-5-10-3-2-4-11(18)9-10/h4-11,13,19,27H,12H2,1-3H3,(H,24,28)(H,25,26);2-5,8-11,14H,6-7H2,1H3,(H,22,25)(H,23,24);2-9H,1H3,(H2,19,22)(H,20,21);2-9H,1H3,(H,20,21);2-9H,1H3,(H,19,20)(H,21,22)/b9-7+;9-5+;3*7-5+/t19-;;;;/m1..../s1
InChIKeyGHFRSFXQAZRRIY-BOTTZUTNSA-N
MW1665.75 g/mol
LogP17.71
Rot. Bonds23

About N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid

N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid (PubChem CID 158255496) has the molecular formula C93H81F5N14O11 and a molecular weight of 1665.75 g/mol. Its IUPAC name is N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid.

Molecular Properties

Compound NameN-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid
PubChem CID158255496
Molecular FormulaC93H81F5N14O11
Molecular Weight1665.75 g/mol
Exact Mass1664.61
IUPAC NameN-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid
SMILESCOc1c(C#N)ccc2[nH]nc(/C=C/c3cccc(F)c3)c12.COc1c(C(=O)NC2CC2)ccc2n[nH]c(/C=C/c3cccc(F)c3)c12.COc1c(C(=O)N[C@H](CO)C(C)C)ccc2n[nH]c(/C=C/c3cccc(F)c3)c12.COc1c(C(=O)O)ccc2n[nH]c(/C=C/c3cccc(F)c3)c12.COc1c(C(N)=O)ccc2n[nH]c(/C=C/c3cccc(F)c3)c12
InChIInChI=1S/C22H24FN3O3.C20H18FN3O2.C17H14FN3O2.C17H12FN3O.C17H13FN2O3/c1-13(2)19(12-27)24-22(28)16-8-10-18-20(21(16)29-3)17(25-26-18)9-7-14-5-4-6-15(23)11-14;1-26-19-15(20(25)22-14-6-7-14)8-10-17-18(19)16(23-24-17)9-5-12-3-2-4-13(21)11-12;1-23-16-12(17(19)22)6-8-14-15(16)13(20-21-14)7-5-10-3-2-4-11(18)9-10;1-22-17-12(10-19)6-8-15-16(17)14(20-21-15)7-5-11-3-2-4-13(18)9-11;1-23-16-12(17(21)22)6-8-14-15(16)13(19-20-14)7-5-10-3-2-4-11(18)9-10/h4-11,13,19,27H,12H2,1-3H3,(H,24,28)(H,25,26);2-5,8-11,14H,6-7H2,1H3,(H,22,25)(H,23,24);2-9H,1H3,(H2,19,22)(H,20,21);2-9H,1H3,(H,20,21);2-9H,1H3,(H,19,20)(H,21,22)/b9-7+;9-5+;3*7-5+/t19-;;;;/m1..../s1
InChIKeyGHFRSFXQAZRRIY-BOTTZUTNSA-N
XLogP17.71
TPSA372.16 Ų
H-Bond Donors10
H-Bond Acceptors16
Rotatable Bonds23
Heavy Atoms123
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001665.75
LogP ≤ 517.71
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1016

Analyze N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid?
The IUPAC name of N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid (CID 158255496) is N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid.
What is the SMILES notation for N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid?
The canonical SMILES for N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid is COc1c(C#N)ccc2[nH]nc(/C=C/c3cccc(F)c3)c12.COc1c(C(=O)NC2CC2)ccc2n[nH]c(/C=C/c3cccc(F)c3)c12.COc1c(C(=O)N[C@H](CO)C(C)C)ccc2n[nH]c(/C=C/c3cccc(F)c3)c12.COc1c(C(=O)O)ccc2n[nH]c(/C=C/c3cccc(F)c3)c12.COc1c(C(N)=O)ccc2n[nH]c(/C=C/c3cccc(F)c3)c12.
What is the InChIKey of N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid?
The InChIKey is GHFRSFXQAZRRIY-BOTTZUTNSA-N. The full InChI is InChI=1S/C22H24FN3O3.C20H18FN3O2.C17H14FN3O2.C17H12FN3O.C17H13FN2O3/c1-13(2)19(12-27)24-22(28)16-8-10-18-20(21(16)29-3)17(25-26-18)9-7-14-5-4-6-15(23)11-14;1-26-19-15(20(25)22-14-6-7-14)8-10-17-18(19)16(23-24-17)9-5-12-3-2-4-13(21)11-12;1-23-16-12(17(19)22)6-8-14-15(16)13(20-21-14)7-5-10-3-2-4-11(18)9-10;1-22-17-12(10-19)6-8-15-16(17)14(20-21-15)7-5-11-3-2-4-13(18)9-11;1-23-16-12(17(21)22)6-8-14-15(16)13(19-20-14)7-5-10-3-2-4-11(18)9-10/h4-11,13,19,27H,12H2,1-3H3,(H,24,28)(H,25,26);2-5,8-11,14H,6-7H2,1H3,(H,22,25)(H,23,24);2-9H,1H3,(H2,19,22)(H,20,21);2-9H,1H3,(H,20,21);2-9H,1H3,(H,19,20)(H,21,22)/b9-7+;9-5+;3*7-5+/t19-;;;;/m1..../s1.
What are the key properties of N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid?
N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid has a molecular weight of 1665.75 g/mol, XLogP of 17.71, 23 rotatable bonds, 10 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-1H-indazole-5-carbonitrile;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxylic acid is sourced from PubChem (CID 158255496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).