N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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

C76H66F8N12O6 — CID 161312569

IUPACN-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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
SMILESCC(=O)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.CC(C)(CO)C(=O)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.CC(C)(O)CC(=O)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.O=C(Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F)C1CC1
InChIInChI=1S/2C20H19F2N3O2.C19H15F2N3O.C17H13F2N3O/c1-20(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;20-14-4-2-1-3-11(14)7-8-16-13-9-18(22-19(25)12-5-6-12)15(21)10-17(13)24-23-16;1-10(23)20-17-8-12-15(21-22-16(12)9-14(17)19)7-6-11-4-2-3-5-13(11)18/h3-10,26H,11H2,1-2H3,(H,23,27)(H,24,25);3-10,27H,11H2,1-2H3,(H,23,26)(H,24,25);1-4,7-10,12H,5-6H2,(H,22,25)(H,23,24);2-9H,1H3,(H,20,23)(H,21,22)/b3*8-7+;7-6+
InChIKeyVJBUDAOPCWJXQH-LKPMIGKPSA-N
MW1395.43 g/mol
LogP16.41
Rot. Bonds17

About N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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 (PubChem CID 161312569) has the molecular formula C76H66F8N12O6 and a molecular weight of 1395.43 g/mol. Its IUPAC name is N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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.

Molecular Properties

Compound NameN-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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
PubChem CID161312569
Molecular FormulaC76H66F8N12O6
Molecular Weight1395.43 g/mol
Exact Mass1394.51
IUPAC NameN-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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
SMILESCC(=O)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.CC(C)(CO)C(=O)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.CC(C)(O)CC(=O)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.O=C(Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F)C1CC1
InChIInChI=1S/2C20H19F2N3O2.C19H15F2N3O.C17H13F2N3O/c1-20(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;20-14-4-2-1-3-11(14)7-8-16-13-9-18(22-19(25)12-5-6-12)15(21)10-17(13)24-23-16;1-10(23)20-17-8-12-15(21-22-16(12)9-14(17)19)7-6-11-4-2-3-5-13(11)18/h3-10,26H,11H2,1-2H3,(H,23,27)(H,24,25);3-10,27H,11H2,1-2H3,(H,23,26)(H,24,25);1-4,7-10,12H,5-6H2,(H,22,25)(H,23,24);2-9H,1H3,(H,20,23)(H,21,22)/b3*8-7+;7-6+
InChIKeyVJBUDAOPCWJXQH-LKPMIGKPSA-N
XLogP16.41
TPSA271.58 Ų
H-Bond Donors10
H-Bond Acceptors10
Rotatable Bonds17
Heavy Atoms102
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001395.43
LogP ≤ 516.41
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1010

Analyze N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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 with MolForge

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Related Compounds

N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide
CID 60034921
N-[6-fluoro-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide
CID 60035138
N-[6-fluoro-3-[2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide
CID 72628231
N-[6-fluoro-3-[2-(3-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide
CID 72628362
CID 157468460
CID 157468460
N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2-phenylpropanamide;[6-fluoro-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-indazol-5-yl]methanamine
CID 157587842
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
CID 159933478
CID 159933478
1-cyano-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclobutanecarboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-6-oxo-1H-pyridine-3-carboxamide
CID 160589132
CID 160713786
CID 160713786
1-acetyl-N-[3-[(E)-2-(3,4-difluorophenyl)ethenyl]-6-fluoro-1H-indazol-5-yl]piperidine-4-carboxamide;N-[3-[(E)-2-(3,4-difluorophenyl)ethenyl]-6-fluoro-1H-indazol-5-yl]cyclopropanecarboxamide;N-[3-[(E)-2-(3,4-difluorophenyl)ethenyl]-6-fluoro-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;3-[(E)-2-(3,4-difluorophenyl)ethenyl]-6-fluoro-1-methylindazol-5-amine
CID 160863311
cis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide
CID 160923017

Frequently Asked Questions

What is the IUPAC name of N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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?
The IUPAC name of N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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 (CID 161312569) is N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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.
What is the SMILES notation for N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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?
The canonical SMILES for N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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 is CC(=O)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.CC(C)(CO)C(=O)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.CC(C)(O)CC(=O)Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F.O=C(Nc1cc2c(/C=C/c3ccccc3F)n[nH]c2cc1F)C1CC1.
What is the InChIKey of N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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?
The InChIKey is VJBUDAOPCWJXQH-LKPMIGKPSA-N. The full InChI is InChI=1S/2C20H19F2N3O2.C19H15F2N3O.C17H13F2N3O/c1-20(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;20-14-4-2-1-3-11(14)7-8-16-13-9-18(22-19(25)12-5-6-12)15(21)10-17(13)24-23-16;1-10(23)20-17-8-12-15(21-22-16(12)9-14(17)19)7-6-11-4-2-3-5-13(11)18/h3-10,26H,11H2,1-2H3,(H,23,27)(H,24,25);3-10,27H,11H2,1-2H3,(H,23,26)(H,24,25);1-4,7-10,12H,5-6H2,(H,22,25)(H,23,24);2-9H,1H3,(H,20,23)(H,21,22)/b3*8-7+;7-6+.
What are the key properties of N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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 has a molecular weight of 1395.43 g/mol, XLogP of 16.41, 17 rotatable bonds, 10 hydrogen bond donors, and 10 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]acetamide;N-[6-fluoro-3-[(E)-2-(2-fluorophenyl)ethenyl]-1H-indazol-5-yl]cyclopropanecarboxamide;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 is sourced from PubChem (CID 161312569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).