N-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide

C26H19N3O3 — CID 69373493

IUPACN-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide
SMILESO=C(Nc1cccc(Oc2ccc3c(C=Cc4ccco4)n[nH]c3c2)c1)c1ccccc1
InChIInChI=1S/C26H19N3O3/c30-26(18-6-2-1-3-7-18)27-19-8-4-9-21(16-19)32-22-11-13-23-24(28-29-25(23)17-22)14-12-20-10-5-15-31-20/h1-17H,(H,27,30)(H,28,29)
InChIKeyDWKBKZYNVMDRPR-UHFFFAOYSA-N
MW421.46 g/mol
LogP6.37
Rot. Bonds6

About N-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide

N-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide (PubChem CID 69373493) has the molecular formula C26H19N3O3 and a molecular weight of 421.46 g/mol. Its IUPAC name is N-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide.

Molecular Properties

Compound NameN-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide
PubChem CID69373493
Molecular FormulaC26H19N3O3
Molecular Weight421.46 g/mol
Exact Mass421.14
IUPAC NameN-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide
SMILESO=C(Nc1cccc(Oc2ccc3c(C=Cc4ccco4)n[nH]c3c2)c1)c1ccccc1
InChIInChI=1S/C26H19N3O3/c30-26(18-6-2-1-3-7-18)27-19-8-4-9-21(16-19)32-22-11-13-23-24(28-29-25(23)17-22)14-12-20-10-5-15-31-20/h1-17H,(H,27,30)(H,28,29)
InChIKeyDWKBKZYNVMDRPR-UHFFFAOYSA-N
XLogP6.37
TPSA80.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.46
LogP ≤ 56.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[[3-[(E)-2-(1H-indazol-4-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide
CID 67552693
6-hydroxy-N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 134135011
2-(2,5-difluorophenyl)-N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]acetamide
CID 134133199
4-oxo-N-[3-[3-[(E)-2-phenylethenyl]-1H-indazole-6-carbonyl]phenyl]pyran-2-carboxamide
CID 134145225
N-[3-[[3-[(E)-2-(1H-imidazol-5-yl)ethenyl]-1H-indol-6-yl]oxy]phenyl]benzamide;N-[3-[[3-[(E)-2-[1-(2-trimethylsilylethoxymethyl)imidazol-4-yl]ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide
CID 158562823
N-[3-[3-[(E)-2-phenylethenyl]-1H-indazole-6-carbonyl]phenyl]-1,2-oxazole-4-carboxamide
CID 69370068
N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]bicyclo[3.3.1]non-6-ene-3-carboxamide
CID 134143744
N-[3-[[3-[2-(1,3-benzodioxol-5-yl)ethenyl]-1H-indazol-6-yl]-methylamino]phenyl]benzamide
CID 69370278
N-[6-[3-[[3-(trifluoromethyl)benzoyl]amino]phenoxy]-1H-indazol-3-yl]pyridine-3-carboxamide
CID 143770344
[3-(methylamino)phenyl]-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]methanone
CID 142037641
N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]benzamide
CID 1343643
(E)-2-methyl-N-[3-[3-[(E)-2-phenylethenyl]-1H-indazole-6-carbonyl]phenyl]but-2-enamide
CID 134151491

Frequently Asked Questions

What is the IUPAC name of N-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide?
The IUPAC name of N-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide (CID 69373493) is N-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide.
What is the SMILES notation for N-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide?
The canonical SMILES for N-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide is O=C(Nc1cccc(Oc2ccc3c(C=Cc4ccco4)n[nH]c3c2)c1)c1ccccc1.
What is the InChIKey of N-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide?
The InChIKey is DWKBKZYNVMDRPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19N3O3/c30-26(18-6-2-1-3-7-18)27-19-8-4-9-21(16-19)32-22-11-13-23-24(28-29-25(23)17-22)14-12-20-10-5-15-31-20/h1-17H,(H,27,30)(H,28,29).
What are the key properties of N-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide?
N-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide has a molecular weight of 421.46 g/mol, XLogP of 6.37, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[3-[2-(furan-2-yl)ethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide is sourced from PubChem (CID 69373493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).