N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide

C143H134F6N22O12S2 — CID 158544536

IUPACN-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide
SMILESC=CS(=O)(=O)Nc1cccc(-c2c(C#N)c3ccc(C(F)(F)F)cc3n2CC)c1.CCCS(=O)(=O)Nc1cccc(-c2c(C#N)c3ccc(C(F)(F)F)cc3n2CC)c1.CCn1c(-c2ccc(C(=O)NCCNC)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(C(N)=O)cc2)c(C#N)c2cc(OC)ccc21.CCn1c(-c2ccc(NC(=O)C3CCC3)cc2)c(C#N)c2ccccc21.CCn1c(-c2ccc(NC(=O)COC)cc2)c(C#N)c2ccccc21.CCn1c(-c2ccc(NC(C)=O)cc2)c(C#N)c2ccccc21
InChIInChI=1S/C22H24N4O2.C22H21N3O.C21H20F3N3O2S.C20H16F3N3O2S.C20H19N3O2.C19H17N3O2.C19H17N3O/c1-4-26-20-13-17(28-3)9-10-18(20)19(14-23)21(26)15-5-7-16(8-6-15)22(27)25-12-11-24-2;1-2-25-20-9-4-3-8-18(20)19(14-23)21(25)15-10-12-17(13-11-15)24-22(26)16-6-5-7-16;1-3-10-30(28,29)26-16-7-5-6-14(11-16)20-18(13-25)17-9-8-15(21(22,23)24)12-19(17)27(20)4-2;1-3-26-18-11-14(20(21,22)23)8-9-16(18)17(12-24)19(26)13-6-5-7-15(10-13)25-29(27,28)4-2;1-3-23-18-7-5-4-6-16(18)17(12-21)20(23)14-8-10-15(11-9-14)22-19(24)13-25-2;1-3-22-17-9-8-14(24-2)10-15(17)16(11-20)18(22)12-4-6-13(7-5-12)19(21)23;1-3-22-18-7-5-4-6-16(18)17(12-20)19(22)14-8-10-15(11-9-14)21-13(2)23/h5-10,13,24H,4,11-12H2,1-3H3,(H,25,27);3-4,8-13,16H,2,5-7H2,1H3,(H,24,26);5-9,11-12,26H,3-4,10H2,1-2H3;4-11,25H,2-3H2,1H3;4-11H,3,13H2,1-2H3,(H,22,24);4-10H,3H2,1-2H3,(H2,21,23);4-11H,3H2,1-2H3,(H,21,23)
InChIKeyHOYGEGPRPFCNMO-UHFFFAOYSA-N
MW2530.91 g/mol
LogP29.82
Rot. Bonds34

About N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide

N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide (PubChem CID 158544536) has the molecular formula C143H134F6N22O12S2 and a molecular weight of 2530.91 g/mol. Its IUPAC name is N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide.

Molecular Properties

Compound NameN-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide
PubChem CID158544536
Molecular FormulaC143H134F6N22O12S2
Molecular Weight2530.91 g/mol
Exact Mass2528.99
IUPAC NameN-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide
SMILESC=CS(=O)(=O)Nc1cccc(-c2c(C#N)c3ccc(C(F)(F)F)cc3n2CC)c1.CCCS(=O)(=O)Nc1cccc(-c2c(C#N)c3ccc(C(F)(F)F)cc3n2CC)c1.CCn1c(-c2ccc(C(=O)NCCNC)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(C(N)=O)cc2)c(C#N)c2cc(OC)ccc21.CCn1c(-c2ccc(NC(=O)C3CCC3)cc2)c(C#N)c2ccccc21.CCn1c(-c2ccc(NC(=O)COC)cc2)c(C#N)c2ccccc21.CCn1c(-c2ccc(NC(C)=O)cc2)c(C#N)c2ccccc21
InChIInChI=1S/C22H24N4O2.C22H21N3O.C21H20F3N3O2S.C20H16F3N3O2S.C20H19N3O2.C19H17N3O2.C19H17N3O/c1-4-26-20-13-17(28-3)9-10-18(20)19(14-23)21(26)15-5-7-16(8-6-15)22(27)25-12-11-24-2;1-2-25-20-9-4-3-8-18(20)19(14-23)21(25)15-10-12-17(13-11-15)24-22(26)16-6-5-7-16;1-3-10-30(28,29)26-16-7-5-6-14(11-16)20-18(13-25)17-9-8-15(21(22,23)24)12-19(17)27(20)4-2;1-3-26-18-11-14(20(21,22)23)8-9-16(18)17(12-24)19(26)13-6-5-7-15(10-13)25-29(27,28)4-2;1-3-23-18-7-5-4-6-16(18)17(12-21)20(23)14-8-10-15(11-9-14)22-19(24)13-25-2;1-3-22-17-9-8-14(24-2)10-15(17)16(11-20)18(22)12-4-6-13(7-5-12)19(21)23;1-3-22-18-7-5-4-6-16(18)17(12-20)19(22)14-8-10-15(11-9-14)21-13(2)23/h5-10,13,24H,4,11-12H2,1-3H3,(H,25,27);3-4,8-13,16H,2,5-7H2,1H3,(H,24,26);5-9,11-12,26H,3-4,10H2,1-2H3;4-11,25H,2-3H2,1H3;4-11H,3,13H2,1-2H3,(H,22,24);4-10H,3H2,1-2H3,(H2,21,23);4-11H,3H2,1-2H3,(H,21,23)
InChIKeyHOYGEGPRPFCNMO-UHFFFAOYSA-N
XLogP29.82
TPSA492.59 Ų
H-Bond Donors8
H-Bond Acceptors27
Rotatable Bonds34
Heavy Atoms185
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002530.91
LogP ≤ 529.82
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

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

Analyze N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide with MolForge

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Related Compounds

N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-propan-2-ylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-propylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-propylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]acetamide
CID 157180715
N-[4-(3-cyano-6-ethoxy-1-propylindol-2-yl)phenyl]ethanesulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]acetamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propanamide
CID 157618931
CID 157655703
CID 157655703
N-[4-[3-cyano-6-(difluoromethoxy)-1-ethylindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-methylindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-methylindol-2-yl]phenyl]methanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propylindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propylindol-2-yl]phenyl]methanesulfonamide;1-[3-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea
CID 157685862
4-[3-cyano-1-cyclobutyl-6-(2-methoxyethoxy)indol-2-yl]-N-[(1R)-1-(4-fluorophenyl)ethyl]benzamide;4-[3-cyano-1-cyclobutyl-6-(2-methoxyethoxy)indol-2-yl]-N-[(1S)-1-phenylethyl]benzamide;1-cyclobutyl-2-[4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]phenyl]-6-(2-methoxyethoxy)indole-3-carbonitrile;1-cyclobutyl-2-[4-(4-methoxyanilino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;1-cyclobutyl-6-(oxan-4-yloxy)-2-[4-[3-(trifluoromethoxy)anilino]phenyl]indole-3-carbonitrile
CID 158112816
N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-2-methylpropanamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-2-phenylacetamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-phenylpropanamide;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-ethyl-6-(trifluoromethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-methyl-6-(trifluoromethoxy)indole-3-carbonitrile
CID 158149040
N,2-bis[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]acetamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-cyclopropylbenzenesulfonamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-(2-hydroxyethyl)benzenesulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;2,2-dimethylpropyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate
CID 158299801
2-(4-aminophenyl)-1-ethyl-5-phenylmethoxyindole-3-carbonitrile;2-(4-aminophenyl)-6-phenylmethoxy-1-propylindole-3-carbonitrile;N-[4-[3-cyano-1-ethyl-6-(trifluoromethoxy)indol-2-yl]phenyl]-3-phenylpropanamide;N-[3-(3-cyano-5-phenylmethoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;N-[3-(3-cyano-5-phenylmethoxy-1-propylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-phenylmethoxy-1-propylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-phenylmethoxy-1-propylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-phenylmethoxy-1-propylindol-2-yl)phenyl]propane-1-sulfonamide
CID 158418916
N-[4-[3-cyano-1-ethyl-6-(2-fluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)-N-propan-2-ylbenzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide;(4-methoxyphenyl) N-[3-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]carbamate
CID 158445629
CID 158451520
CID 158451520
1-butyl-3-[4-[3-cyano-1-ethyl-6-(trifluoromethoxy)indol-2-yl]phenyl]urea;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]cyclopropanecarboxamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-2-methylpropanamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-2-phenylacetamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-phenylpropanamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]propanamide;1-[4-[3-cyano-1-ethyl-6-(trifluoromethoxy)indol-2-yl]phenyl]-3-propylurea;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-ethyl-6-(trifluoromethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-methyl-6-(trifluoromethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-propyl-6-(trifluoromethoxy)indole-3-carbonitrile
CID 158902083
2-(4-aminophenyl)-6-phenylmethoxy-1-propylindole-3-carbonitrile;N-[4-[3-cyano-1-ethyl-6-(2-fluoroethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethoxy)indol-2-yl]phenyl]acetamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethoxy)indol-2-yl]phenyl]-2,2-dimethylpropanamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethoxy)indol-2-yl]phenyl]-3-phenylbutanamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethoxy)indol-2-yl]phenyl]propanamide
CID 159043348

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide?
The IUPAC name of N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide (CID 158544536) is N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide.
What is the SMILES notation for N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide?
The canonical SMILES for N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide is C=CS(=O)(=O)Nc1cccc(-c2c(C#N)c3ccc(C(F)(F)F)cc3n2CC)c1.CCCS(=O)(=O)Nc1cccc(-c2c(C#N)c3ccc(C(F)(F)F)cc3n2CC)c1.CCn1c(-c2ccc(C(=O)NCCNC)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(C(N)=O)cc2)c(C#N)c2cc(OC)ccc21.CCn1c(-c2ccc(NC(=O)C3CCC3)cc2)c(C#N)c2ccccc21.CCn1c(-c2ccc(NC(=O)COC)cc2)c(C#N)c2ccccc21.CCn1c(-c2ccc(NC(C)=O)cc2)c(C#N)c2ccccc21.
What is the InChIKey of N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide?
The InChIKey is HOYGEGPRPFCNMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2.C22H21N3O.C21H20F3N3O2S.C20H16F3N3O2S.C20H19N3O2.C19H17N3O2.C19H17N3O/c1-4-26-20-13-17(28-3)9-10-18(20)19(14-23)21(26)15-5-7-16(8-6-15)22(27)25-12-11-24-2;1-2-25-20-9-4-3-8-18(20)19(14-23)21(25)15-10-12-17(13-11-15)24-22(26)16-6-5-7-16;1-3-10-30(28,29)26-16-7-5-6-14(11-16)20-18(13-25)17-9-8-15(21(22,23)24)12-19(17)27(20)4-2;1-3-26-18-11-14(20(21,22)23)8-9-16(18)17(12-24)19(26)13-6-5-7-15(10-13)25-29(27,28)4-2;1-3-23-18-7-5-4-6-16(18)17(12-21)20(23)14-8-10-15(11-9-14)22-19(24)13-25-2;1-3-22-17-9-8-14(24-2)10-15(17)16(11-20)18(22)12-4-6-13(7-5-12)19(21)23;1-3-22-18-7-5-4-6-16(18)17(12-20)19(22)14-8-10-15(11-9-14)21-13(2)23/h5-10,13,24H,4,11-12H2,1-3H3,(H,25,27);3-4,8-13,16H,2,5-7H2,1H3,(H,24,26);5-9,11-12,26H,3-4,10H2,1-2H3;4-11,25H,2-3H2,1H3;4-11H,3,13H2,1-2H3,(H,22,24);4-10H,3H2,1-2H3,(H2,21,23);4-11H,3H2,1-2H3,(H,21,23).
What are the key properties of N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide?
N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide has a molecular weight of 2530.91 g/mol, XLogP of 29.82, 34 rotatable bonds, 8 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide is sourced from PubChem (CID 158544536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).