1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate

C235H258FN39O21 — CID 157387558

IUPAC1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate
SMILESC=CCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CC)cc1.CCCCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CC)cc1.CCCCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CCC)cc1.CCCCn1c(-c2ccc(NC(=O)NC(C)C)cc2)c(C#N)c2ccc(OCC)cc21.CCCCn1c(-c2ccc(NC(=O)NCC)cc2)c(C#N)c2ccc(OCC)cc21.CCCCn1c(-c2ccc(NC(=O)OCCF)cc2)c(C#N)c2ccc(OCC)cc21.CCCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CC)cc1.CCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CC)cc1.CCOc1ccc2c(C#N)c(-c3ccc(NC(=O)NCCc4ccccc4)cc3)n(CC)c2c1.CCn1c(-c2ccc(NC(=O)NC(C)C)cc2)c(C#N)c2cc(OC)ccc21
InChIInChI=1S/C28H28N4O2.C25H30N4O2.C24H26FN3O3.2C24H28N4O2.C23H26N4O2.2C22H24N4O2.C22H22N4O2.C21H22N4O2/c1-3-32-26-18-23(34-4-2)14-15-24(26)25(19-29)27(32)21-10-12-22(13-11-21)31-28(33)30-17-16-20-8-6-5-7-9-20;1-5-7-14-29-23-15-20(31-6-2)12-13-21(23)22(16-26)24(29)18-8-10-19(11-9-18)28-25(30)27-17(3)4;1-3-5-13-28-22-15-19(30-4-2)10-11-20(22)21(16-26)23(28)17-6-8-18(9-7-17)27-24(29)31-14-12-25;1-4-6-13-26-24(29)27-18-9-7-17(8-10-18)23-21(16-25)20-15-19(30-3)11-12-22(20)28(23)14-5-2;1-4-7-14-28-22-15-19(30-6-3)12-13-20(22)21(16-25)23(28)17-8-10-18(11-9-17)27-24(29)26-5-2;1-4-6-13-25-23(28)26-17-9-7-16(8-10-17)22-20(15-24)19-14-18(29-3)11-12-21(19)27(22)5-2;1-5-26-20-11-10-17(28-4)12-18(20)19(13-23)21(26)15-6-8-16(9-7-15)25-22(27)24-14(2)3;2*1-4-12-24-22(27)25-16-8-6-15(7-9-16)21-19(14-23)18-13-17(28-3)10-11-20(18)26(21)5-2;1-4-23-21(26)24-15-8-6-14(7-9-15)20-18(13-22)17-12-16(27-3)10-11-19(17)25(20)5-2/h5-15,18H,3-4,16-17H2,1-2H3,(H2,30,31,33);8-13,15,17H,5-7,14H2,1-4H3,(H2,27,28,30);6-11,15H,3-5,12-14H2,1-2H3,(H,27,29);7-12,15H,4-6,13-14H2,1-3H3,(H2,26,27,29);8-13,15H,4-7,14H2,1-3H3,(H2,26,27,29);7-12,14H,4-6,13H2,1-3H3,(H2,25,26,28);6-12,14H,5H2,1-4H3,(H2,24,25,27);6-11,13H,4-5,12H2,1-3H3,(H2,24,25,27);4,6-11,13H,1,5,12H2,2-3H3,(H2,24,25,27);6-12H,4-5H2,1-3H3,(H2,23,24,26)
InChIKeyBLPMTYPMENYNIW-UHFFFAOYSA-N
MW3983.90 g/mol
LogP52.28
Rot. Bonds70

About 1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate

1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate (PubChem CID 157387558) has the molecular formula C235H258FN39O21 and a molecular weight of 3983.90 g/mol. Its IUPAC name is 1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate.

Molecular Properties

Compound Name1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate
PubChem CID157387558
Molecular FormulaC235H258FN39O21
Molecular Weight3983.90 g/mol
Exact Mass3981.03
IUPAC Name1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate
SMILESC=CCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CC)cc1.CCCCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CC)cc1.CCCCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CCC)cc1.CCCCn1c(-c2ccc(NC(=O)NC(C)C)cc2)c(C#N)c2ccc(OCC)cc21.CCCCn1c(-c2ccc(NC(=O)NCC)cc2)c(C#N)c2ccc(OCC)cc21.CCCCn1c(-c2ccc(NC(=O)OCCF)cc2)c(C#N)c2ccc(OCC)cc21.CCCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CC)cc1.CCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CC)cc1.CCOc1ccc2c(C#N)c(-c3ccc(NC(=O)NCCc4ccccc4)cc3)n(CC)c2c1.CCn1c(-c2ccc(NC(=O)NC(C)C)cc2)c(C#N)c2cc(OC)ccc21
InChIInChI=1S/C28H28N4O2.C25H30N4O2.C24H26FN3O3.2C24H28N4O2.C23H26N4O2.2C22H24N4O2.C22H22N4O2.C21H22N4O2/c1-3-32-26-18-23(34-4-2)14-15-24(26)25(19-29)27(32)21-10-12-22(13-11-21)31-28(33)30-17-16-20-8-6-5-7-9-20;1-5-7-14-29-23-15-20(31-6-2)12-13-21(23)22(16-26)24(29)18-8-10-19(11-9-18)28-25(30)27-17(3)4;1-3-5-13-28-22-15-19(30-4-2)10-11-20(22)21(16-26)23(28)17-6-8-18(9-7-17)27-24(29)31-14-12-25;1-4-6-13-26-24(29)27-18-9-7-17(8-10-18)23-21(16-25)20-15-19(30-3)11-12-22(20)28(23)14-5-2;1-4-7-14-28-22-15-19(30-6-3)12-13-20(22)21(16-25)23(28)17-8-10-18(11-9-17)27-24(29)26-5-2;1-4-6-13-25-23(28)26-17-9-7-16(8-10-17)22-20(15-24)19-14-18(29-3)11-12-21(19)27(22)5-2;1-5-26-20-11-10-17(28-4)12-18(20)19(13-23)21(26)15-6-8-16(9-7-15)25-22(27)24-14(2)3;2*1-4-12-24-22(27)25-16-8-6-15(7-9-16)21-19(14-23)18-13-17(28-3)10-11-20(18)26(21)5-2;1-4-23-21(26)24-15-8-6-14(7-9-15)20-18(13-22)17-12-16(27-3)10-11-19(17)25(20)5-2/h5-15,18H,3-4,16-17H2,1-2H3,(H2,30,31,33);8-13,15,17H,5-7,14H2,1-4H3,(H2,27,28,30);6-11,15H,3-5,12-14H2,1-2H3,(H,27,29);7-12,15H,4-6,13-14H2,1-3H3,(H2,26,27,29);8-13,15H,4-7,14H2,1-3H3,(H2,26,27,29);7-12,14H,4-6,13H2,1-3H3,(H2,25,26,28);6-12,14H,5H2,1-4H3,(H2,24,25,27);6-11,13H,4-5,12H2,1-3H3,(H2,24,25,27);4,6-11,13H,1,5,12H2,2-3H3,(H2,24,25,27);6-12H,4-5H2,1-3H3,(H2,23,24,26)
InChIKeyBLPMTYPMENYNIW-UHFFFAOYSA-N
XLogP52.28
TPSA788.00 Ų
H-Bond Donors19
H-Bond Acceptors41
Rotatable Bonds70
Heavy Atoms296
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003983.90
LogP ≤ 552.28
H-Bond Donors ≤ 519
H-Bond Acceptors ≤ 1041

Computed Properties (RDKit)

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

Analyze 1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate with MolForge

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Launch Full Analysis

Related Compounds

1-butyl-3-[4-(1-butyl-3-cyano-6-methoxyindol-2-yl)phenyl]urea;1-[4-(1-butyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(1-butyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-methoxyindol-2-yl)phenyl]carbamate
CID 162035153
1-butyl-3-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]urea
CID 58694419
1-butyl-3-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]urea;molecular hydrogen
CID 143184904
1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propylurea;1-butyl-3-[3-[3-cyano-1-ethyl-6-(3-morpholin-4-ylpropoxy)indol-2-yl]phenyl]urea;1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]-3-prop-2-enylurea;1-[4-[3-cyano-6-ethoxy-1-(2-methylpropyl)indol-2-yl]phenyl]-3-ethylurea;1-[4-[3-cyano-6-ethoxy-1-(2-methylpropyl)indol-2-yl]phenyl]-3-propylurea;ethyl N-[4-(3-cyano-6-ethoxy-1-propan-2-ylindol-2-yl)phenyl]carbamate;ethyl N-[4-(3-cyano-6-ethoxy-1-propylindol-2-yl)phenyl]carbamate;1-ethyl-6-(3-morpholin-4-ylpropoxy)-2-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]indole-3-carbonitrile;1-ethyl-6-(3-morpholin-4-ylpropoxy)-2-[3-(2-oxopyrrolidin-1-yl)phenyl]indole-3-carbonitrile;2-fluoroethyl N-[4-(3-cyano-6-ethoxy-1-propylindol-2-yl)phenyl]carbamate;methyl N-[4-(3-cyano-6-ethoxy-1-propylindol-2-yl)phenyl]carbamate;2-methylpropyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate
CID 159202023
2-fluoroethyl N-[4-[3-cyano-1-ethyl-6-(2-methoxyethoxy)indol-2-yl]phenyl]carbamate
CID 59425203
tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propylurea;1-butyl-3-[3-[3-cyano-1-ethyl-6-(3-morpholin-4-ylpropoxy)indol-2-yl]phenyl]urea;1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]-3-prop-2-enylurea;ethyl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate;ethyl N-[4-(3-cyano-6-ethoxy-1-propan-2-ylindol-2-yl)phenyl]carbamate;ethyl N-[4-(3-cyano-6-ethoxy-1-propylindol-2-yl)phenyl]carbamate;1-ethyl-6-(3-morpholin-4-ylpropoxy)-2-[3-(2-oxoimidazolidin-1-yl)phenyl]indole-3-carbonitrile;1-ethyl-6-(3-morpholin-4-ylpropoxy)-2-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]indole-3-carbonitrile;2-fluoroethyl N-[4-(3-cyano-6-ethoxy-1-propylindol-2-yl)phenyl]carbamate;2-methylpropyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate;propyl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate
CID 161061936
1-(2-chloroethyl)-3-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]urea;1-(3-chloropropyl)-3-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]urea;N-[4-(3-cyano-1-ethyl-5-fluoroindol-2-yl)phenyl]ethanesulfonamide;1-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-3-(4-propan-2-ylphenyl)urea;ethyl N-[3-[3-cyano-1-ethyl-6-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]carbamate
CID 159366563
1-(2-chloroethyl)-3-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]urea
CID 59425419
2-methylpropyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate
CID 58694187
2-fluoroethyl N-[4-[3-cyano-6-(difluoromethoxy)-1-propylindol-2-yl]phenyl]carbamate;2-methoxyethyl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate;2-methoxyethyl N-[4-[3-cyano-6-(difluoromethoxy)-1-propylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-6-(difluoromethoxy)-1-propylindol-2-yl]phenyl]carbamate
CID 157420704
5-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-ethyl-2,3-dihydroindole-1-carboxamide;5-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-propan-2-yl-2,3-dihydroindole-1-carboxamide;5-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-propyl-2,3-dihydroindole-1-carboxamide;2-(2,3-dihydro-1H-indol-5-yl)-1-ethyl-6-methoxyindole-3-carbonitrile;propyl N-[4-[3-cyano-6-methoxy-1-(2-methoxyethyl)indol-2-yl]phenyl]carbamate
CID 161360876
1-butyl-3-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-2-fluorophenyl]urea
CID 25049866

Frequently Asked Questions

What is the IUPAC name of 1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate?
The IUPAC name of 1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate (CID 157387558) is 1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate.
What is the SMILES notation for 1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate?
The canonical SMILES for 1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate is C=CCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CC)cc1.CCCCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CC)cc1.CCCCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CCC)cc1.CCCCn1c(-c2ccc(NC(=O)NC(C)C)cc2)c(C#N)c2ccc(OCC)cc21.CCCCn1c(-c2ccc(NC(=O)NCC)cc2)c(C#N)c2ccc(OCC)cc21.CCCCn1c(-c2ccc(NC(=O)OCCF)cc2)c(C#N)c2ccc(OCC)cc21.CCCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CC)cc1.CCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CC)cc1.CCOc1ccc2c(C#N)c(-c3ccc(NC(=O)NCCc4ccccc4)cc3)n(CC)c2c1.CCn1c(-c2ccc(NC(=O)NC(C)C)cc2)c(C#N)c2cc(OC)ccc21.
What is the InChIKey of 1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate?
The InChIKey is BLPMTYPMENYNIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28N4O2.C25H30N4O2.C24H26FN3O3.2C24H28N4O2.C23H26N4O2.2C22H24N4O2.C22H22N4O2.C21H22N4O2/c1-3-32-26-18-23(34-4-2)14-15-24(26)25(19-29)27(32)21-10-12-22(13-11-21)31-28(33)30-17-16-20-8-6-5-7-9-20;1-5-7-14-29-23-15-20(31-6-2)12-13-21(23)22(16-26)24(29)18-8-10-19(11-9-18)28-25(30)27-17(3)4;1-3-5-13-28-22-15-19(30-4-2)10-11-20(22)21(16-26)23(28)17-6-8-18(9-7-17)27-24(29)31-14-12-25;1-4-6-13-26-24(29)27-18-9-7-17(8-10-18)23-21(16-25)20-15-19(30-3)11-12-22(20)28(23)14-5-2;1-4-7-14-28-22-15-19(30-6-3)12-13-20(22)21(16-25)23(28)17-8-10-18(11-9-17)27-24(29)26-5-2;1-4-6-13-25-23(28)26-17-9-7-16(8-10-17)22-20(15-24)19-14-18(29-3)11-12-21(19)27(22)5-2;1-5-26-20-11-10-17(28-4)12-18(20)19(13-23)21(26)15-6-8-16(9-7-15)25-22(27)24-14(2)3;2*1-4-12-24-22(27)25-16-8-6-15(7-9-16)21-19(14-23)18-13-17(28-3)10-11-20(18)26(21)5-2;1-4-23-21(26)24-15-8-6-14(7-9-15)20-18(13-22)17-12-16(27-3)10-11-19(17)25(20)5-2/h5-15,18H,3-4,16-17H2,1-2H3,(H2,30,31,33);8-13,15,17H,5-7,14H2,1-4H3,(H2,27,28,30);6-11,15H,3-5,12-14H2,1-2H3,(H,27,29);7-12,15H,4-6,13-14H2,1-3H3,(H2,26,27,29);8-13,15H,4-7,14H2,1-3H3,(H2,26,27,29);7-12,14H,4-6,13H2,1-3H3,(H2,25,26,28);6-12,14H,5H2,1-4H3,(H2,24,25,27);6-11,13H,4-5,12H2,1-3H3,(H2,24,25,27);4,6-11,13H,1,5,12H2,2-3H3,(H2,24,25,27);6-12H,4-5H2,1-3H3,(H2,23,24,26).
What are the key properties of 1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate?
1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate has a molecular weight of 3983.90 g/mol, XLogP of 52.28, 70 rotatable bonds, 19 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-butyl-3-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]urea;1-butyl-3-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]urea;1-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-propylurea;2-fluoroethyl N-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]carbamate is sourced from PubChem (CID 157387558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).