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

C81H64F8N14O5 — CID 160589132

IUPAC1-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
SMILESCC(C)(C)C(=O)Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F.N#CC1(C(=O)Nc2cc3c(/C=C/c4ccc(F)cc4)n[nH]c3cc2F)CC1.O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)C1CCC1.O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)c1ccc(=O)[nH]c1
InChIInChI=1S/C21H14F2N4O2.C20H14F2N4O.C20H17F2N3O.C20H19F2N3O/c22-14-5-1-12(2-6-14)3-7-17-15-9-19(16(23)10-18(15)27-26-17)25-21(29)13-4-8-20(28)24-11-13;21-13-4-1-12(2-5-13)3-6-16-14-9-18(15(22)10-17(14)26-25-16)24-19(27)20(11-23)7-8-20;21-14-7-4-12(5-8-14)6-9-17-15-10-19(16(22)11-18(15)25-24-17)23-20(26)13-2-1-3-13;1-20(2,3)19(26)23-18-10-14-16(24-25-17(14)11-15(18)22)9-6-12-4-7-13(21)8-5-12/h1-11H,(H,24,28)(H,25,29)(H,26,27);1-6,9-10H,7-8H2,(H,24,27)(H,25,26);4-11,13H,1-3H2,(H,23,26)(H,24,25);4-11H,1-3H3,(H,23,26)(H,24,25)/b7-3+;6-3+;2*9-6+
InChIKeyRCTVLVASNOBXCM-MOJOBDFNSA-N
MW1465.48 g/mol
LogP17.95
Rot. Bonds15

About 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

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 (PubChem CID 160589132) has the molecular formula C81H64F8N14O5 and a molecular weight of 1465.48 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name1-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
PubChem CID160589132
Molecular FormulaC81H64F8N14O5
Molecular Weight1465.48 g/mol
Exact Mass1464.51
IUPAC Name1-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
SMILESCC(C)(C)C(=O)Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F.N#CC1(C(=O)Nc2cc3c(/C=C/c4ccc(F)cc4)n[nH]c3cc2F)CC1.O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)C1CCC1.O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)c1ccc(=O)[nH]c1
InChIInChI=1S/C21H14F2N4O2.C20H14F2N4O.C20H17F2N3O.C20H19F2N3O/c22-14-5-1-12(2-6-14)3-7-17-15-9-19(16(23)10-18(15)27-26-17)25-21(29)13-4-8-20(28)24-11-13;21-13-4-1-12(2-5-13)3-6-16-14-9-18(15(22)10-17(14)26-25-16)24-19(27)20(11-23)7-8-20;21-14-7-4-12(5-8-14)6-9-17-15-10-19(16(22)11-18(15)25-24-17)23-20(26)13-2-1-3-13;1-20(2,3)19(26)23-18-10-14-16(24-25-17(14)11-15(18)22)9-6-12-4-7-13(21)8-5-12/h1-11H,(H,24,28)(H,25,29)(H,26,27);1-6,9-10H,7-8H2,(H,24,27)(H,25,26);4-11,13H,1-3H2,(H,23,26)(H,24,25);4-11H,1-3H3,(H,23,26)(H,24,25)/b7-3+;6-3+;2*9-6+
InChIKeyRCTVLVASNOBXCM-MOJOBDFNSA-N
XLogP17.95
TPSA287.77 Ų
H-Bond Donors9
H-Bond Acceptors10
Rotatable Bonds15
Heavy Atoms108
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001465.48
LogP ≤ 517.95
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1010

Analyze 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 with MolForge

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Related Compounds

1-acetyl-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]piperidine-4-carboxamide;1-amino-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]piperidine-2-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]piperidine-4-carboxamide
CID 158617366
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
1-tert-butyl-3-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]urea;1-ethyl-3-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]urea;1-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-propan-2-ylurea;1-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-propylurea
CID 162052737

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC(C)(C)C(=O)Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F.N#CC1(C(=O)Nc2cc3c(/C=C/c4ccc(F)cc4)n[nH]c3cc2F)CC1.O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)C1CCC1.O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)c1ccc(=O)[nH]c1.
What is the InChIKey of 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?
The InChIKey is RCTVLVASNOBXCM-MOJOBDFNSA-N. The full InChI is InChI=1S/C21H14F2N4O2.C20H14F2N4O.C20H17F2N3O.C20H19F2N3O/c22-14-5-1-12(2-6-14)3-7-17-15-9-19(16(23)10-18(15)27-26-17)25-21(29)13-4-8-20(28)24-11-13;21-13-4-1-12(2-5-13)3-6-16-14-9-18(15(22)10-17(14)26-25-16)24-19(27)20(11-23)7-8-20;21-14-7-4-12(5-8-14)6-9-17-15-10-19(16(22)11-18(15)25-24-17)23-20(26)13-2-1-3-13;1-20(2,3)19(26)23-18-10-14-16(24-25-17(14)11-15(18)22)9-6-12-4-7-13(21)8-5-12/h1-11H,(H,24,28)(H,25,29)(H,26,27);1-6,9-10H,7-8H2,(H,24,27)(H,25,26);4-11,13H,1-3H2,(H,23,26)(H,24,25);4-11H,1-3H3,(H,23,26)(H,24,25)/b7-3+;6-3+;2*9-6+.
What are the key properties of 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?
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 has a molecular weight of 1465.48 g/mol, XLogP of 17.95, 15 rotatable bonds, 9 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 160589132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).