2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone

C122H110N14O4 — CID 159680372

IUPAC2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone
SMILESC(=C/c1n[nH]c2ccccc12)\c1ccccc1.CC(=O)Cc1ccc2n[nH]c(/C=C/c3ccccc3)c2c1.CCCCC(=O)Cc1ccc2n[nH]c(/C=C/c3ccccc3)c2c1.CN(C)CCc1ccc(/C=C/c2n[nH]c3ccccc23)cc1.O=C(Cc1ccc2n[nH]c(/C=C/c3ccccc3)c2c1)Cc1c[nH]c2ccccc12.O=C(Cc1ccc2n[nH]c(/C=C/c3ccccc3)c2c1)c1ccccc1
InChIInChI=1S/C26H21N3O.C23H18N2O.C21H22N2O.C19H21N3.C18H16N2O.C15H12N2/c30-21(16-20-17-27-24-9-5-4-8-22(20)24)14-19-11-13-26-23(15-19)25(28-29-26)12-10-18-6-2-1-3-7-18;26-23(19-9-5-2-6-10-19)16-18-12-14-22-20(15-18)21(24-25-22)13-11-17-7-3-1-4-8-17;1-2-3-9-18(24)14-17-11-13-21-19(15-17)20(22-23-21)12-10-16-7-5-4-6-8-16;1-22(2)14-13-16-9-7-15(8-10-16)11-12-19-17-5-3-4-6-18(17)20-21-19;1-13(21)11-15-8-10-18-16(12-15)17(19-20-18)9-7-14-5-3-2-4-6-14;1-2-6-12(7-3-1)10-11-15-13-8-4-5-9-14(13)16-17-15/h1-13,15,17,27H,14,16H2,(H,28,29);1-15H,16H2,(H,24,25);4-8,10-13,15H,2-3,9,14H2,1H3,(H,22,23);3-12H,13-14H2,1-2H3,(H,20,21);2-10,12H,11H2,1H3,(H,19,20);1-11H,(H,16,17)/b12-10+;13-11+;12-10+;12-11+;9-7+;11-10+
InChIKeyMVDDSYWYXIDADL-FIMAFNTDSA-N
MW1836.32 g/mol
LogP27.20
Rot. Bonds29

About 2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone

2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone (PubChem CID 159680372) has the molecular formula C122H110N14O4 and a molecular weight of 1836.32 g/mol. Its IUPAC name is 2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone.

Molecular Properties

Compound Name2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone
PubChem CID159680372
Molecular FormulaC122H110N14O4
Molecular Weight1836.32 g/mol
Exact Mass1834.88
IUPAC Name2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone
SMILESC(=C/c1n[nH]c2ccccc12)\c1ccccc1.CC(=O)Cc1ccc2n[nH]c(/C=C/c3ccccc3)c2c1.CCCCC(=O)Cc1ccc2n[nH]c(/C=C/c3ccccc3)c2c1.CN(C)CCc1ccc(/C=C/c2n[nH]c3ccccc23)cc1.O=C(Cc1ccc2n[nH]c(/C=C/c3ccccc3)c2c1)Cc1c[nH]c2ccccc12.O=C(Cc1ccc2n[nH]c(/C=C/c3ccccc3)c2c1)c1ccccc1
InChIInChI=1S/C26H21N3O.C23H18N2O.C21H22N2O.C19H21N3.C18H16N2O.C15H12N2/c30-21(16-20-17-27-24-9-5-4-8-22(20)24)14-19-11-13-26-23(15-19)25(28-29-26)12-10-18-6-2-1-3-7-18;26-23(19-9-5-2-6-10-19)16-18-12-14-22-20(15-18)21(24-25-22)13-11-17-7-3-1-4-8-17;1-2-3-9-18(24)14-17-11-13-21-19(15-17)20(22-23-21)12-10-16-7-5-4-6-8-16;1-22(2)14-13-16-9-7-15(8-10-16)11-12-19-17-5-3-4-6-18(17)20-21-19;1-13(21)11-15-8-10-18-16(12-15)17(19-20-18)9-7-14-5-3-2-4-6-14;1-2-6-12(7-3-1)10-11-15-13-8-4-5-9-14(13)16-17-15/h1-13,15,17,27H,14,16H2,(H,28,29);1-15H,16H2,(H,24,25);4-8,10-13,15H,2-3,9,14H2,1H3,(H,22,23);3-12H,13-14H2,1-2H3,(H,20,21);2-10,12H,11H2,1H3,(H,19,20);1-11H,(H,16,17)/b12-10+;13-11+;12-10+;12-11+;9-7+;11-10+
InChIKeyMVDDSYWYXIDADL-FIMAFNTDSA-N
XLogP27.20
TPSA259.39 Ų
H-Bond Donors7
H-Bond Acceptors11
Rotatable Bonds29
Heavy Atoms140
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001836.32
LogP ≤ 527.20
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1011

Analyze 2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone with MolForge

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Related Compounds

4-[(E)-2-(1H-indazol-3-yl)ethenyl]benzoic acid
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4-(1H-indol-3-yl)-1-phenylbutan-1-one
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N-[2-(1H-indol-3-yl)ethyl]-3-phenyl-N-[(E)-3-phenylprop-2-enyl]propanamide
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ethane;fluoromethane;3-[(E)-2-phenylethenyl]-1H-indazole
CID 142995649
N-[2-(1H-indol-3-yl)ethyl]-N-[(E)-2-methyl-3-phenylprop-2-enyl]butanamide
CID 42697546
N-benzyl-N-[2-(1H-indol-3-yl)ethyl]pentanamide
CID 42695889
N-butyl-N-[2-[(3,4-dichlorophenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]-3-phenylprop-2-enamide
CID 5157043
6-(1H-indol-3-yl)hexan-3-one
CID 58575746
1-(1H-indol-3-yl)hexan-3-one
CID 166814803
N-[2-[benzyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]-N-butyl-3-phenylprop-2-enamide
CID 3468318
(E)-3-[4-[[acetyl-[2-(1H-indol-3-yl)ethyl]amino]methyl]phenyl]-N-hydroxyprop-2-enamide
CID 20579514
4-[[3-(dimethylamino)propyl-[2-(2-methoxyphenyl)acetyl]amino]methyl]-N-hydroxybenzamide;N-hydroxy-4-[[2-(4-hydroxyphenyl)ethyl-[2-(2-methoxyphenyl)acetyl]amino]methyl]benzamide;N-hydroxy-4-[[3-hydroxypropyl-[2-(2-methoxyphenyl)acetyl]amino]methyl]benzamide;N-hydroxy-4-[[2-(1H-indol-3-yl)ethyl-[2-(2-methoxyphenyl)acetyl]amino]methyl]benzamide;N-hydroxy-4-[4-(2-methoxyphenyl)-3-oxobutyl]benzamide
CID 158983695

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone?
The IUPAC name of 2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone (CID 159680372) is 2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone.
What is the SMILES notation for 2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone?
The canonical SMILES for 2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone is C(=C/c1n[nH]c2ccccc12)\c1ccccc1.CC(=O)Cc1ccc2n[nH]c(/C=C/c3ccccc3)c2c1.CCCCC(=O)Cc1ccc2n[nH]c(/C=C/c3ccccc3)c2c1.CN(C)CCc1ccc(/C=C/c2n[nH]c3ccccc23)cc1.O=C(Cc1ccc2n[nH]c(/C=C/c3ccccc3)c2c1)Cc1c[nH]c2ccccc12.O=C(Cc1ccc2n[nH]c(/C=C/c3ccccc3)c2c1)c1ccccc1.
What is the InChIKey of 2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone?
The InChIKey is MVDDSYWYXIDADL-FIMAFNTDSA-N. The full InChI is InChI=1S/C26H21N3O.C23H18N2O.C21H22N2O.C19H21N3.C18H16N2O.C15H12N2/c30-21(16-20-17-27-24-9-5-4-8-22(20)24)14-19-11-13-26-23(15-19)25(28-29-26)12-10-18-6-2-1-3-7-18;26-23(19-9-5-2-6-10-19)16-18-12-14-22-20(15-18)21(24-25-22)13-11-17-7-3-1-4-8-17;1-2-3-9-18(24)14-17-11-13-21-19(15-17)20(22-23-21)12-10-16-7-5-4-6-8-16;1-22(2)14-13-16-9-7-15(8-10-16)11-12-19-17-5-3-4-6-18(17)20-21-19;1-13(21)11-15-8-10-18-16(12-15)17(19-20-18)9-7-14-5-3-2-4-6-14;1-2-6-12(7-3-1)10-11-15-13-8-4-5-9-14(13)16-17-15/h1-13,15,17,27H,14,16H2,(H,28,29);1-15H,16H2,(H,24,25);4-8,10-13,15H,2-3,9,14H2,1H3,(H,22,23);3-12H,13-14H2,1-2H3,(H,20,21);2-10,12H,11H2,1H3,(H,19,20);1-11H,(H,16,17)/b12-10+;13-11+;12-10+;12-11+;9-7+;11-10+.
What are the key properties of 2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone?
2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone has a molecular weight of 1836.32 g/mol, XLogP of 27.20, 29 rotatable bonds, 7 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-N,N-dimethylethanamine;1-(1H-indol-3-yl)-3-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;3-[(E)-2-phenylethenyl]-1H-indazole;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]hexan-2-one;1-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]propan-2-one;1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone is sourced from PubChem (CID 159680372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).