N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide

C96H87F10N15O10 — CID 158624505

IUPACN-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide
SMILESCC(C)(CO)C(=O)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.CC(C)(O)CC(=O)Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F.CC(C)(O)CC(=O)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.O=C(CCO)Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F.O=C(CCO)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F
InChIInChI=1S/3C20H19F2N3O2.2C18H15F2N3O2/c1-20(2,27)11-19(26)23-18-9-14-16(24-25-17(14)10-15(18)22)8-5-12-3-6-13(21)7-4-12;1-20(2,11-26)19(27)23-18-9-13-16(24-25-17(13)10-15(18)22)8-7-12-5-3-4-6-14(12)21;1-20(2,27)11-19(26)23-18-9-13-16(24-25-17(13)10-15(18)22)8-7-12-5-3-4-6-14(12)21;19-12-4-1-11(2-5-12)3-6-15-13-9-17(21-18(25)7-8-24)14(20)10-16(13)23-22-15;19-13-4-2-1-3-11(13)5-6-15-12-9-17(21-18(25)7-8-24)14(20)10-16(12)23-22-15/h3-10,27H,11H2,1-2H3,(H,23,26)(H,24,25);3-10,26H,11H2,1-2H3,(H,23,27)(H,24,25);3-10,27H,11H2,1-2H3,(H,23,26)(H,24,25);2*1-6,9-10,24H,7-8H2,(H,21,25)(H,22,23)/b8-5+;2*8-7+;6-3+;6-5+
InChIKeyHYKNPXCKMUNODT-YHVDWPRTSA-N
MW1800.83 g/mol
LogP18.86
Rot. Bonds25

About N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide

N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide (PubChem CID 158624505) has the molecular formula C96H87F10N15O10 and a molecular weight of 1800.83 g/mol. Its IUPAC name is N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide.

Molecular Properties

Compound NameN-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide
PubChem CID158624505
Molecular FormulaC96H87F10N15O10
Molecular Weight1800.83 g/mol
Exact Mass1799.66
IUPAC NameN-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide
SMILESCC(C)(CO)C(=O)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.CC(C)(O)CC(=O)Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F.CC(C)(O)CC(=O)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.O=C(CCO)Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F.O=C(CCO)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F
InChIInChI=1S/3C20H19F2N3O2.2C18H15F2N3O2/c1-20(2,27)11-19(26)23-18-9-14-16(24-25-17(14)10-15(18)22)8-5-12-3-6-13(21)7-4-12;1-20(2,11-26)19(27)23-18-9-13-16(24-25-17(13)10-15(18)22)8-7-12-5-3-4-6-14(12)21;1-20(2,27)11-19(26)23-18-9-13-16(24-25-17(13)10-15(18)22)8-7-12-5-3-4-6-14(12)21;19-12-4-1-11(2-5-12)3-6-15-13-9-17(21-18(25)7-8-24)14(20)10-16(13)23-22-15;19-13-4-2-1-3-11(13)5-6-15-12-9-17(21-18(25)7-8-24)14(20)10-16(12)23-22-15/h3-10,27H,11H2,1-2H3,(H,23,26)(H,24,25);3-10,26H,11H2,1-2H3,(H,23,27)(H,24,25);3-10,27H,11H2,1-2H3,(H,23,26)(H,24,25);2*1-6,9-10,24H,7-8H2,(H,21,25)(H,22,23)/b8-5+;2*8-7+;6-3+;6-5+
InChIKeyHYKNPXCKMUNODT-YHVDWPRTSA-N
XLogP18.86
TPSA390.05 Ų
H-Bond Donors15
H-Bond Acceptors15
Rotatable Bonds25
Heavy Atoms131
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001800.83
LogP ≤ 518.86
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1015

Analyze N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide?
The IUPAC name of N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide (CID 158624505) is N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide.
What is the SMILES notation for N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide?
The canonical SMILES for N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide is CC(C)(CO)C(=O)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.CC(C)(O)CC(=O)Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F.CC(C)(O)CC(=O)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.O=C(CCO)Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F.O=C(CCO)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.
What is the InChIKey of N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide?
The InChIKey is HYKNPXCKMUNODT-YHVDWPRTSA-N. The full InChI is InChI=1S/3C20H19F2N3O2.2C18H15F2N3O2/c1-20(2,27)11-19(26)23-18-9-14-16(24-25-17(14)10-15(18)22)8-5-12-3-6-13(21)7-4-12;1-20(2,11-26)19(27)23-18-9-13-16(24-25-17(13)10-15(18)22)8-7-12-5-3-4-6-14(12)21;1-20(2,27)11-19(26)23-18-9-13-16(24-25-17(13)10-15(18)22)8-7-12-5-3-4-6-14(12)21;19-12-4-1-11(2-5-12)3-6-15-13-9-17(21-18(25)7-8-24)14(20)10-16(13)23-22-15;19-13-4-2-1-3-11(13)5-6-15-12-9-17(21-18(25)7-8-24)14(20)10-16(12)23-22-15/h3-10,27H,11H2,1-2H3,(H,23,26)(H,24,25);3-10,26H,11H2,1-2H3,(H,23,27)(H,24,25);3-10,27H,11H2,1-2H3,(H,23,26)(H,24,25);2*1-6,9-10,24H,7-8H2,(H,21,25)(H,22,23)/b8-5+;2*8-7+;6-3+;6-5+.
What are the key properties of N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide?
N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide has a molecular weight of 1800.83 g/mol, XLogP of 18.86, 25 rotatable bonds, 15 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-3-methylbutanamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxypropanamide is sourced from PubChem (CID 158624505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).