N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide

C167H159N17O12 — CID 157332571

IUPACN-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide
SMILESC=C(c1cc(C)c(C)c(OC)c1)c1ccc2[nH]cc(/C=C/C(=O)Cc3ccccc3N)c2c1.C=C(c1cc(C)c(C)c(OC)c1)c1ccc2[nH]cc(C(=O)Nc3ccccc3N)c2c1.C=C(c1cc(C)c(C)c(OC)c1)c1ccc2c(c1)c(/C=C/C(=O)Cc1ccccc1N)cn2C.C=C(c1cc(C)c(C)c(OC)c1)c1ccc2c(c1)c(C(=O)Nc1ccccc1N)cn2C.C=C(c1ccc(OC)c(/C=C/C(=O)Nc2ccccc2N)c1)c1cc(C)nc2ccccc12.C=C(c1ccc(OC)c(/C=C/C(=O)Nc2ccccc2N)c1)c1nc(C)nc2ccccc12
InChIInChI=1S/C30H30N2O2.C29H28N2O2.C28H25N3O2.C27H24N4O2.C27H27N3O2.C26H25N3O2/c1-19-14-25(17-30(34-5)20(19)2)21(3)22-11-13-29-27(16-22)24(18-32(29)4)10-12-26(33)15-23-8-6-7-9-28(23)31;1-18-13-24(16-29(33-4)19(18)2)20(3)21-10-12-28-26(15-21)23(17-31-28)9-11-25(32)14-22-7-5-6-8-27(22)30;1-18-16-23(22-8-4-6-10-25(22)30-18)19(2)20-12-14-27(33-3)21(17-20)13-15-28(32)31-26-11-7-5-9-24(26)29;1-17(27-21-8-4-6-10-23(21)29-18(2)30-27)19-12-14-25(33-3)20(16-19)13-15-26(32)31-24-11-7-5-9-22(24)28;1-16-12-20(14-26(32-5)17(16)2)18(3)19-10-11-25-21(13-19)22(15-30(25)4)27(31)29-24-9-7-6-8-23(24)28;1-15-11-19(13-25(31-4)16(15)2)17(3)18-9-10-23-20(12-18)21(14-28-23)26(30)29-24-8-6-5-7-22(24)27/h6-14,16-18H,3,15,31H2,1-2,4-5H3;5-13,15-17,31H,3,14,30H2,1-2,4H3;4-17H,2,29H2,1,3H3,(H,31,32);4-16H,1,28H2,2-3H3,(H,31,32);6-15H,3,28H2,1-2,4-5H3,(H,29,31);5-14,28H,3,27H2,1-2,4H3,(H,29,30)/b12-10+;11-9+;2*15-13+;;
InChIKeyBFLPVIFGBOYRMK-JDDWTIIWSA-N
MW2596.22 g/mol
LogP35.01
Rot. Bonds36

About N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide

N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide (PubChem CID 157332571) has the molecular formula C167H159N17O12 and a molecular weight of 2596.22 g/mol. Its IUPAC name is N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide
PubChem CID157332571
Molecular FormulaC167H159N17O12
Molecular Weight2596.22 g/mol
Exact Mass2594.24
IUPAC NameN-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide
SMILESC=C(c1cc(C)c(C)c(OC)c1)c1ccc2[nH]cc(/C=C/C(=O)Cc3ccccc3N)c2c1.C=C(c1cc(C)c(C)c(OC)c1)c1ccc2[nH]cc(C(=O)Nc3ccccc3N)c2c1.C=C(c1cc(C)c(C)c(OC)c1)c1ccc2c(c1)c(/C=C/C(=O)Cc1ccccc1N)cn2C.C=C(c1cc(C)c(C)c(OC)c1)c1ccc2c(c1)c(C(=O)Nc1ccccc1N)cn2C.C=C(c1ccc(OC)c(/C=C/C(=O)Nc2ccccc2N)c1)c1cc(C)nc2ccccc12.C=C(c1ccc(OC)c(/C=C/C(=O)Nc2ccccc2N)c1)c1nc(C)nc2ccccc12
InChIInChI=1S/C30H30N2O2.C29H28N2O2.C28H25N3O2.C27H24N4O2.C27H27N3O2.C26H25N3O2/c1-19-14-25(17-30(34-5)20(19)2)21(3)22-11-13-29-27(16-22)24(18-32(29)4)10-12-26(33)15-23-8-6-7-9-28(23)31;1-18-13-24(16-29(33-4)19(18)2)20(3)21-10-12-28-26(15-21)23(17-31-28)9-11-25(32)14-22-7-5-6-8-27(22)30;1-18-16-23(22-8-4-6-10-25(22)30-18)19(2)20-12-14-27(33-3)21(17-20)13-15-28(32)31-26-11-7-5-9-24(26)29;1-17(27-21-8-4-6-10-23(21)29-18(2)30-27)19-12-14-25(33-3)20(16-19)13-15-26(32)31-24-11-7-5-9-22(24)28;1-16-12-20(14-26(32-5)17(16)2)18(3)19-10-11-25-21(13-19)22(15-30(25)4)27(31)29-24-9-7-6-8-23(24)28;1-15-11-19(13-25(31-4)16(15)2)17(3)18-9-10-23-20(12-18)21(14-28-23)26(30)29-24-8-6-5-7-22(24)27/h6-14,16-18H,3,15,31H2,1-2,4-5H3;5-13,15-17,31H,3,14,30H2,1-2,4H3;4-17H,2,29H2,1,3H3,(H,31,32);4-16H,1,28H2,2-3H3,(H,31,32);6-15H,3,28H2,1-2,4-5H3,(H,29,31);5-14,28H,3,27H2,1-2,4H3,(H,29,30)/b12-10+;11-9+;2*15-13+;;
InChIKeyBFLPVIFGBOYRMK-JDDWTIIWSA-N
XLogP35.01
TPSA442.15 Ų
H-Bond Donors12
H-Bond Acceptors23
Rotatable Bonds36
Heavy Atoms196
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002596.22
LogP ≤ 535.01
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide with MolForge

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Related Compounds

methanesulfonic acid;10-[3-[3-[(9-methoxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-1-yl)amino]propyl-methylamino]propylamino]-1,14-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaen-8-one
CID 438996
Distel
CID 132608
Distel(2+)
CID 157796
3-(3-fluorophenyl)-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-8-methoxy-9-pyrimidin-5-yl-5,6-dihydropyrrolo[2,1-a]isoquinoline-2-carboxamide
CID 71536100
9-[2-(dimethylamino)pyrimidin-5-yl]-3-(3-fluorophenyl)-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-8-methoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2-carboxamide
CID 71536101
3-(3-fluorophenyl)-N-[1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-8-methoxy-9-pyrimidin-5-yl-5,6-dihydropyrrolo[2,1-a]isoquinoline-2-carboxamide
CID 78102669
9-[2-(dimethylamino)pyrimidin-5-yl]-3-(3-fluorophenyl)-N-[1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-8-methoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2-carboxamide
CID 78102670
1-(3H-benzimidazol-5-yl)-4-(2-fluorophenyl)butane-1,4-dione;1-(3H-benzimidazol-5-yl)-4-[2-(trifluoromethyl)phenyl]butane-1,4-dione;1-(3H-benzimidazol-5-yl)-4-[3-(trifluoromethyl)phenyl]butane-1,4-dione;1-(3H-benzimidazol-5-yl)-4-[4-(trifluoromethyl)phenyl]butane-1,4-dione;1-(1H-indol-5-yl)-4-(4-methoxyphenyl)butane-1,4-dione;1-(1H-indol-5-yl)-4-phenylbutane-1,4-dione;1-(1H-indol-5-yl)-4-pyridin-2-ylbutane-1,4-dione;1-(1H-indol-5-yl)-4-pyridin-3-ylbutane-1,4-dione;1-(1H-indol-5-yl)-4-pyridin-4-ylbutane-1,4-dione
CID 160191476
5-[1-(2,3-difluorophenyl)-2-oxo-3H-benzimidazol-4-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(3-fluoro-4-methylphenyl)-2-(trifluoromethyl)pyridine-3-carboxamide;5-(3,3-dimethyl-2-oxo-1-pyrimidin-2-ylindol-4-yl)-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-(3,3-dimethyl-2-oxo-1-pyrimidin-2-ylindol-4-yl)-N-(4-methylphenyl)-2-(trifluoromethoxy)benzamide
CID 161681537
(5R)-5-[4-[1-(cyclopropylmethyl)-6-(trifluoromethyl)benzimidazol-4-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-methylpyrrolo[2,3-b]pyridin-5-yl)phenyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-methylpyrrolo[2,3-b]pyridin-6-yl)phenyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-(4-pyrimidin-2-ylphenyl)imidazolidine-2,4-dione
CID 161728454
N-[(4-methoxyphenyl)methyl]-3-methyl-4-[(4-pyridin-3-yl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)methyl]aniline;N-[4-methyl-3-[(5-methyl-4-pyridin-3-ylpyrrolo[3,2-d]pyrimidin-2-yl)methyl]phenyl]-3-(trifluoromethyl)benzamide;N-[4-[[3-methyl-4-[(4-pyridin-3-yl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)methyl]anilino]methyl]phenyl]acetamide;N-[4-methyl-3-[(4-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)methyl]phenyl]-3-(trifluoromethyl)benzamide;4-methyl-3-[(4-pyridin-3-yl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)methyl]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 161741749
5-[1-(2,3-difluorophenyl)-2-oxo-3H-benzimidazol-4-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(3,4-dimethylphenyl)-2-(trifluoromethyl)pyridine-3-carboxamide;5-(3,3-dimethyl-2-oxo-1-pyrimidin-2-ylindol-4-yl)-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-(3,3-dimethyl-2-oxo-1-pyrimidin-2-ylindol-4-yl)-N-(4-methylphenyl)-2-(trifluoromethoxy)benzamide
CID 161818287

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide?
The IUPAC name of N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide (CID 157332571) is N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide.
What is the SMILES notation for N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide?
The canonical SMILES for N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide is C=C(c1cc(C)c(C)c(OC)c1)c1ccc2[nH]cc(/C=C/C(=O)Cc3ccccc3N)c2c1.C=C(c1cc(C)c(C)c(OC)c1)c1ccc2[nH]cc(C(=O)Nc3ccccc3N)c2c1.C=C(c1cc(C)c(C)c(OC)c1)c1ccc2c(c1)c(/C=C/C(=O)Cc1ccccc1N)cn2C.C=C(c1cc(C)c(C)c(OC)c1)c1ccc2c(c1)c(C(=O)Nc1ccccc1N)cn2C.C=C(c1ccc(OC)c(/C=C/C(=O)Nc2ccccc2N)c1)c1cc(C)nc2ccccc12.C=C(c1ccc(OC)c(/C=C/C(=O)Nc2ccccc2N)c1)c1nc(C)nc2ccccc12.
What is the InChIKey of N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide?
The InChIKey is BFLPVIFGBOYRMK-JDDWTIIWSA-N. The full InChI is InChI=1S/C30H30N2O2.C29H28N2O2.C28H25N3O2.C27H24N4O2.C27H27N3O2.C26H25N3O2/c1-19-14-25(17-30(34-5)20(19)2)21(3)22-11-13-29-27(16-22)24(18-32(29)4)10-12-26(33)15-23-8-6-7-9-28(23)31;1-18-13-24(16-29(33-4)19(18)2)20(3)21-10-12-28-26(15-21)23(17-31-28)9-11-25(32)14-22-7-5-6-8-27(22)30;1-18-16-23(22-8-4-6-10-25(22)30-18)19(2)20-12-14-27(33-3)21(17-20)13-15-28(32)31-26-11-7-5-9-24(26)29;1-17(27-21-8-4-6-10-23(21)29-18(2)30-27)19-12-14-25(33-3)20(16-19)13-15-26(32)31-24-11-7-5-9-22(24)28;1-16-12-20(14-26(32-5)17(16)2)18(3)19-10-11-25-21(13-19)22(15-30(25)4)27(31)29-24-9-7-6-8-23(24)28;1-15-11-19(13-25(31-4)16(15)2)17(3)18-9-10-23-20(12-18)21(14-28-23)26(30)29-24-8-6-5-7-22(24)27/h6-14,16-18H,3,15,31H2,1-2,4-5H3;5-13,15-17,31H,3,14,30H2,1-2,4H3;4-17H,2,29H2,1,3H3,(H,31,32);4-16H,1,28H2,2-3H3,(H,31,32);6-15H,3,28H2,1-2,4-5H3,(H,29,31);5-14,28H,3,27H2,1-2,4H3,(H,29,30)/b12-10+;11-9+;2*15-13+;;.
What are the key properties of N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide?
N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide has a molecular weight of 2596.22 g/mol, XLogP of 35.01, 36 rotatable bonds, 12 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1H-indol-3-yl]but-3-en-2-one;N-(2-aminophenyl)-5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindole-3-carboxamide;(E)-1-(2-aminophenyl)-4-[5-[1-(3-methoxy-4,5-dimethylphenyl)ethenyl]-1-methylindol-3-yl]but-3-en-2-one;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinazolin-4-yl)ethenyl]phenyl]prop-2-enamide;(E)-N-(2-aminophenyl)-3-[2-methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenyl]prop-2-enamide is sourced from PubChem (CID 157332571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).