benzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile

C177H156Cl4N24O16 — CID 159326401

IUPACbenzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile
SMILESCCOC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC)cc3n2CC)cc1.CCn1c(-c2ccc(C(=O)N3CCCC3)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(C(=O)N3CCOCC3)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(NC(=O)OCc3ccccc3)cc2)c(C#N)c2ccc(OC)cc21.CCn1cc(-c2cc(-c3ccc(OC)cc3)on2)c2ccc(OC)cc21.CCn1cc(C#N)c2cc(Cl)ccc21.CCn1cc(C#N)c2ccc(Cl)cc21.COc1ccc(-n2cc(C#N)c3ccc(Cl)cc32)cc1.COc1ccc(-n2cc(C#N)c3ccccc32)cc1.N#Cc1c[nH]c2cc(Cl)ccc12
InChIInChI=1S/C26H23N3O3.C23H23N3O3.C23H23N3O2.C21H21N3O3.C21H20N2O3.C16H11ClN2O.C16H12N2O.2C11H9ClN2.C9H5ClN2/c1-3-29-24-15-21(31-2)13-14-22(24)23(16-27)25(29)19-9-11-20(12-10-19)28-26(30)32-17-18-7-5-4-6-8-18;1-3-26-21-14-18(28-2)8-9-19(21)20(15-24)22(26)16-4-6-17(7-5-16)23(27)25-10-12-29-13-11-25;1-3-26-21-14-18(28-2)10-11-19(21)20(15-24)22(26)16-6-8-17(9-7-16)23(27)25-12-4-5-13-25;1-4-24-19-12-16(26-3)10-11-17(19)18(13-22)20(24)14-6-8-15(9-7-14)23-21(25)27-5-2;1-4-23-13-18(17-10-9-16(25-3)11-20(17)23)19-12-21(26-22-19)14-5-7-15(24-2)8-6-14;1-20-14-5-3-13(4-6-14)19-10-11(9-18)15-7-2-12(17)8-16(15)19;1-19-14-8-6-13(7-9-14)18-11-12(10-17)15-4-2-3-5-16(15)18;1-2-14-7-8(6-13)10-5-9(12)3-4-11(10)14;1-2-14-7-8(6-13)10-4-3-9(12)5-11(10)14;10-7-1-2-8-6(4-11)5-12-9(8)3-7/h4-15H,3,17H2,1-2H3,(H,28,30);4-9,14H,3,10-13H2,1-2H3;6-11,14H,3-5,12-13H2,1-2H3;6-12H,4-5H2,1-3H3,(H,23,25);5-13H,4H2,1-3H3;2-8,10H,1H3;2-9,11H,1H3;2*3-5,7H,2H2,1H3;1-3,5,12H
InChIKeyLEKMYMUWZRZEKB-UHFFFAOYSA-N
MW3017.16 g/mol
LogP40.60
Rot. Bonds30

About benzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile

benzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile (PubChem CID 159326401) has the molecular formula C177H156Cl4N24O16 and a molecular weight of 3017.16 g/mol. Its IUPAC name is benzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile.

Molecular Properties

Compound Namebenzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile
PubChem CID159326401
Molecular FormulaC177H156Cl4N24O16
Molecular Weight3017.16 g/mol
Exact Mass3013.09
IUPAC Namebenzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile
SMILESCCOC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC)cc3n2CC)cc1.CCn1c(-c2ccc(C(=O)N3CCCC3)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(C(=O)N3CCOCC3)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(NC(=O)OCc3ccccc3)cc2)c(C#N)c2ccc(OC)cc21.CCn1cc(-c2cc(-c3ccc(OC)cc3)on2)c2ccc(OC)cc21.CCn1cc(C#N)c2cc(Cl)ccc21.CCn1cc(C#N)c2ccc(Cl)cc21.COc1ccc(-n2cc(C#N)c3ccc(Cl)cc32)cc1.COc1ccc(-n2cc(C#N)c3ccccc32)cc1.N#Cc1c[nH]c2cc(Cl)ccc12
InChIInChI=1S/C26H23N3O3.C23H23N3O3.C23H23N3O2.C21H21N3O3.C21H20N2O3.C16H11ClN2O.C16H12N2O.2C11H9ClN2.C9H5ClN2/c1-3-29-24-15-21(31-2)13-14-22(24)23(16-27)25(29)19-9-11-20(12-10-19)28-26(30)32-17-18-7-5-4-6-8-18;1-3-26-21-14-18(28-2)8-9-19(21)20(15-24)22(26)16-4-6-17(7-5-16)23(27)25-10-12-29-13-11-25;1-3-26-21-14-18(28-2)10-11-19(21)20(15-24)22(26)16-6-8-17(9-7-16)23(27)25-12-4-5-13-25;1-4-24-19-12-16(26-3)10-11-17(19)18(13-22)20(24)14-6-8-15(9-7-14)23-21(25)27-5-2;1-4-23-13-18(17-10-9-16(25-3)11-20(17)23)19-12-21(26-22-19)14-5-7-15(24-2)8-6-14;1-20-14-5-3-13(4-6-14)19-10-11(9-18)15-7-2-12(17)8-16(15)19;1-19-14-8-6-13(7-9-14)18-11-12(10-17)15-4-2-3-5-16(15)18;1-2-14-7-8(6-13)10-5-9(12)3-4-11(10)14;1-2-14-7-8(6-13)10-4-3-9(12)5-11(10)14;10-7-1-2-8-6(4-11)5-12-9(8)3-7/h4-15H,3,17H2,1-2H3,(H,28,30);4-9,14H,3,10-13H2,1-2H3;6-11,14H,3-5,12-13H2,1-2H3;6-12H,4-5H2,1-3H3,(H,23,25);5-13H,4H2,1-3H3;2-8,10H,1H3;2-9,11H,1H3;2*3-5,7H,2H2,1H3;1-3,5,12H
InChIKeyLEKMYMUWZRZEKB-UHFFFAOYSA-N
XLogP40.60
TPSA500.65 Ų
H-Bond Donors3
H-Bond Acceptors35
Rotatable Bonds30
Heavy Atoms221
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003017.16
LogP ≤ 540.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1035

Analyze benzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile with MolForge

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Related Compounds

1-(1,3-benzodioxol-5-yl)-6-fluoroindole-3-carbonitrile;1-(1,3-benzodioxol-5-yl)-6-methylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;ethyl 4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzoate;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile
CID 160114720
6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile
CID 161134826
bis(1-(1,3-benzodioxol-5-yl)-6-fluoroindole-3-carbonitrile);6-chloro-1H-indole-3-carbonitrile;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile
CID 161531015
1-(1,3-benzodioxol-5-yl)-6-fluoroindole-3-carbonitrile;1-(1,3-benzodioxol-5-yl)-6-methylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile
CID 161697982
5-Chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-(4-methoxyphenyl)indole-3-carbonitrile
CID 161909524
1-(1,3-benzodioxol-5-yl)-6-methylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile
CID 162043434
2-(4-aminophenyl)-5-chloro-1-ethylindole-3-carbonitrile;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-(3,4-dimethoxyphenyl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-(3-morpholin-4-ylpropyl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-(4-nitrophenyl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-phenylbenzamide
CID 162043808

Frequently Asked Questions

What is the IUPAC name of benzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile?
The IUPAC name of benzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile (CID 159326401) is benzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile.
What is the SMILES notation for benzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile?
The canonical SMILES for benzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile is CCOC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC)cc3n2CC)cc1.CCn1c(-c2ccc(C(=O)N3CCCC3)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(C(=O)N3CCOCC3)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(NC(=O)OCc3ccccc3)cc2)c(C#N)c2ccc(OC)cc21.CCn1cc(-c2cc(-c3ccc(OC)cc3)on2)c2ccc(OC)cc21.CCn1cc(C#N)c2cc(Cl)ccc21.CCn1cc(C#N)c2ccc(Cl)cc21.COc1ccc(-n2cc(C#N)c3ccc(Cl)cc32)cc1.COc1ccc(-n2cc(C#N)c3ccccc32)cc1.N#Cc1c[nH]c2cc(Cl)ccc12.
What is the InChIKey of benzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile?
The InChIKey is LEKMYMUWZRZEKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N3O3.C23H23N3O3.C23H23N3O2.C21H21N3O3.C21H20N2O3.C16H11ClN2O.C16H12N2O.2C11H9ClN2.C9H5ClN2/c1-3-29-24-15-21(31-2)13-14-22(24)23(16-27)25(29)19-9-11-20(12-10-19)28-26(30)32-17-18-7-5-4-6-8-18;1-3-26-21-14-18(28-2)8-9-19(21)20(15-24)22(26)16-4-6-17(7-5-16)23(27)25-10-12-29-13-11-25;1-3-26-21-14-18(28-2)10-11-19(21)20(15-24)22(26)16-6-8-17(9-7-16)23(27)25-12-4-5-13-25;1-4-24-19-12-16(26-3)10-11-17(19)18(13-22)20(24)14-6-8-15(9-7-14)23-21(25)27-5-2;1-4-23-13-18(17-10-9-16(25-3)11-20(17)23)19-12-21(26-22-19)14-5-7-15(24-2)8-6-14;1-20-14-5-3-13(4-6-14)19-10-11(9-18)15-7-2-12(17)8-16(15)19;1-19-14-8-6-13(7-9-14)18-11-12(10-17)15-4-2-3-5-16(15)18;1-2-14-7-8(6-13)10-5-9(12)3-4-11(10)14;1-2-14-7-8(6-13)10-4-3-9(12)5-11(10)14;10-7-1-2-8-6(4-11)5-12-9(8)3-7/h4-15H,3,17H2,1-2H3,(H,28,30);4-9,14H,3,10-13H2,1-2H3;6-11,14H,3-5,12-13H2,1-2H3;6-12H,4-5H2,1-3H3,(H,23,25);5-13H,4H2,1-3H3;2-8,10H,1H3;2-9,11H,1H3;2*3-5,7H,2H2,1H3;1-3,5,12H.
What are the key properties of benzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile?
benzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile has a molecular weight of 3017.16 g/mol, XLogP of 40.60, 30 rotatable bonds, 3 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1H-indole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;3-(1-ethyl-6-methoxyindol-3-yl)-5-(4-methoxyphenyl)-1,2-oxazole;1-ethyl-6-methoxy-2-[4-(morpholine-4-carbonyl)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(pyrrolidine-1-carbonyl)phenyl]indole-3-carbonitrile;1-(4-methoxyphenyl)indole-3-carbonitrile is sourced from PubChem (CID 159326401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).