1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate

C281H304N42O33 — CID 160783811

IUPAC1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate
SMILESCC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCCn4ncnn4)cc3n2C2CCC2)cc1)C1CC1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCc4ncn[nH]4)cc3n2C2CCC2)cc1)C1CC1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(Oc4ncncn4)cc3n2C2CCC2)cc1)C1CC1.CCOc1ccc2c(-c3ccn(C)n3)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3cnco3)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nc(C)co3)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nn(C)cc3C)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3oncc3C)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(C3=NCC=C3)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(C3=NCC=C3C)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1
InChIInChI=1S/C29H34N4O3.C29H33N3O3.C28H29N7O3.C28H26N6O3.C28H28N6O3.C28H32N4O3.2C28H31N3O4.C28H31N3O3.C27H29N3O4/c1-6-35-23-14-15-24-25(16-23)33(22-8-7-9-22)28(26(24)27-19(4)17-32(5)31-27)20-10-12-21(13-11-20)30-29(34)36-18(2)3;1-5-34-23-13-14-24-25(17-23)32(22-7-6-8-22)28(26(24)27-19(4)15-16-30-27)20-9-11-21(12-10-20)31-29(33)35-18(2)3;1-18(19-5-6-19)38-28(36)32-21-9-7-20(8-10-21)27-25(16-29)24-12-11-23(37-14-13-34-31-17-30-33-34)15-26(24)35(27)22-3-2-4-22;1-17(18-5-6-18)36-28(35)33-20-9-7-19(8-10-20)26-24(14-29)23-12-11-22(37-27-31-15-30-16-32-27)13-25(23)34(26)21-3-2-4-21;1-17(18-5-6-18)37-28(35)32-20-9-7-19(8-10-20)27-24(14-29)23-12-11-22(36-15-26-30-16-31-33-26)13-25(23)34(27)21-3-2-4-21;1-5-34-22-13-14-23-25(17-22)32(21-7-6-8-21)27(26(23)24-15-16-31(4)30-24)19-9-11-20(12-10-19)29-28(33)35-18(2)3;1-5-33-22-13-14-23-24(15-22)31(21-7-6-8-21)26(25(23)27-29-18(4)16-34-27)19-9-11-20(12-10-19)30-28(32)35-17(2)3;1-5-33-22-13-14-23-24(15-22)31(21-7-6-8-21)26(25(23)27-18(4)16-29-35-27)19-9-11-20(12-10-19)30-28(32)34-17(2)3;1-4-33-22-14-15-23-25(17-22)31(21-7-5-8-21)27(26(23)24-9-6-16-29-24)19-10-12-20(13-11-19)30-28(32)34-18(2)3;1-4-32-21-12-13-22-23(14-21)30(20-6-5-7-20)26(25(22)24-15-28-16-33-24)18-8-10-19(11-9-18)29-27(31)34-17(2)3/h10-18,22H,6-9H2,1-5H3,(H,30,34);9-15,17-18,22H,5-8,16H2,1-4H3,(H,31,33);7-12,15,17-19,22H,2-6,13-14H2,1H3,(H,32,36);7-13,15-18,21H,2-6H2,1H3,(H,33,35);7-13,16-18,21H,2-6,15H2,1H3,(H,32,35)(H,30,31,33);9-18,21H,5-8H2,1-4H3,(H,29,33);2*9-17,21H,5-8H2,1-4H3,(H,30,32);6,9-15,17-18,21H,4-5,7-8,16H2,1-3H3,(H,30,32);8-17,20H,4-7H2,1-3H3,(H,29,31)
InChIKeySAXZQXUNKFCKJO-UHFFFAOYSA-N
MW4797.78 g/mol
LogP67.02
Rot. Bonds73

About 1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate

1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate (PubChem CID 160783811) has the molecular formula C281H304N42O33 and a molecular weight of 4797.78 g/mol. Its IUPAC name is 1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate.

Molecular Properties

Compound Name1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate
PubChem CID160783811
Molecular FormulaC281H304N42O33
Molecular Weight4797.78 g/mol
Exact Mass4794.34
IUPAC Name1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate
SMILESCC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCCn4ncnn4)cc3n2C2CCC2)cc1)C1CC1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCc4ncn[nH]4)cc3n2C2CCC2)cc1)C1CC1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(Oc4ncncn4)cc3n2C2CCC2)cc1)C1CC1.CCOc1ccc2c(-c3ccn(C)n3)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3cnco3)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nc(C)co3)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nn(C)cc3C)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3oncc3C)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(C3=NCC=C3)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(C3=NCC=C3C)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1
InChIInChI=1S/C29H34N4O3.C29H33N3O3.C28H29N7O3.C28H26N6O3.C28H28N6O3.C28H32N4O3.2C28H31N3O4.C28H31N3O3.C27H29N3O4/c1-6-35-23-14-15-24-25(16-23)33(22-8-7-9-22)28(26(24)27-19(4)17-32(5)31-27)20-10-12-21(13-11-20)30-29(34)36-18(2)3;1-5-34-23-13-14-24-25(17-23)32(22-7-6-8-22)28(26(24)27-19(4)15-16-30-27)20-9-11-21(12-10-20)31-29(33)35-18(2)3;1-18(19-5-6-19)38-28(36)32-21-9-7-20(8-10-21)27-25(16-29)24-12-11-23(37-14-13-34-31-17-30-33-34)15-26(24)35(27)22-3-2-4-22;1-17(18-5-6-18)36-28(35)33-20-9-7-19(8-10-20)26-24(14-29)23-12-11-22(37-27-31-15-30-16-32-27)13-25(23)34(26)21-3-2-4-21;1-17(18-5-6-18)37-28(35)32-20-9-7-19(8-10-20)27-24(14-29)23-12-11-22(36-15-26-30-16-31-33-26)13-25(23)34(27)21-3-2-4-21;1-5-34-22-13-14-23-25(17-22)32(21-7-6-8-21)27(26(23)24-15-16-31(4)30-24)19-9-11-20(12-10-19)29-28(33)35-18(2)3;1-5-33-22-13-14-23-24(15-22)31(21-7-6-8-21)26(25(23)27-29-18(4)16-34-27)19-9-11-20(12-10-19)30-28(32)35-17(2)3;1-5-33-22-13-14-23-24(15-22)31(21-7-6-8-21)26(25(23)27-18(4)16-29-35-27)19-9-11-20(12-10-19)30-28(32)34-17(2)3;1-4-33-22-14-15-23-25(17-22)31(21-7-5-8-21)27(26(23)24-9-6-16-29-24)19-10-12-20(13-11-19)30-28(32)34-18(2)3;1-4-32-21-12-13-22-23(14-21)30(20-6-5-7-20)26(25(22)24-15-28-16-33-24)18-8-10-19(11-9-18)29-27(31)34-17(2)3/h10-18,22H,6-9H2,1-5H3,(H,30,34);9-15,17-18,22H,5-8,16H2,1-4H3,(H,31,33);7-12,15,17-19,22H,2-6,13-14H2,1H3,(H,32,36);7-13,15-18,21H,2-6H2,1H3,(H,33,35);7-13,16-18,21H,2-6,15H2,1H3,(H,32,35)(H,30,31,33);9-18,21H,5-8H2,1-4H3,(H,29,33);2*9-17,21H,5-8H2,1-4H3,(H,30,32);6,9-15,17-18,21H,4-5,7-8,16H2,1-3H3,(H,30,32);8-17,20H,4-7H2,1-3H3,(H,29,31)
InChIKeySAXZQXUNKFCKJO-UHFFFAOYSA-N
XLogP67.02
TPSA858.56 Ų
H-Bond Donors11
H-Bond Acceptors64
Rotatable Bonds73
Heavy Atoms356
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004797.78
LogP ≤ 567.02
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1064

Analyze 1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate?
The IUPAC name of 1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate (CID 160783811) is 1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate.
What is the SMILES notation for 1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate?
The canonical SMILES for 1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate is CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCCn4ncnn4)cc3n2C2CCC2)cc1)C1CC1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCc4ncn[nH]4)cc3n2C2CCC2)cc1)C1CC1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(Oc4ncncn4)cc3n2C2CCC2)cc1)C1CC1.CCOc1ccc2c(-c3ccn(C)n3)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3cnco3)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nc(C)co3)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nn(C)cc3C)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3oncc3C)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(C3=NCC=C3)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(C3=NCC=C3C)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.
What is the InChIKey of 1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate?
The InChIKey is SAXZQXUNKFCKJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H34N4O3.C29H33N3O3.C28H29N7O3.C28H26N6O3.C28H28N6O3.C28H32N4O3.2C28H31N3O4.C28H31N3O3.C27H29N3O4/c1-6-35-23-14-15-24-25(16-23)33(22-8-7-9-22)28(26(24)27-19(4)17-32(5)31-27)20-10-12-21(13-11-20)30-29(34)36-18(2)3;1-5-34-23-13-14-24-25(17-23)32(22-7-6-8-22)28(26(24)27-19(4)15-16-30-27)20-9-11-21(12-10-20)31-29(33)35-18(2)3;1-18(19-5-6-19)38-28(36)32-21-9-7-20(8-10-21)27-25(16-29)24-12-11-23(37-14-13-34-31-17-30-33-34)15-26(24)35(27)22-3-2-4-22;1-17(18-5-6-18)36-28(35)33-20-9-7-19(8-10-20)26-24(14-29)23-12-11-22(37-27-31-15-30-16-32-27)13-25(23)34(26)21-3-2-4-21;1-17(18-5-6-18)37-28(35)32-20-9-7-19(8-10-20)27-24(14-29)23-12-11-22(36-15-26-30-16-31-33-26)13-25(23)34(27)21-3-2-4-21;1-5-34-22-13-14-23-25(17-22)32(21-7-6-8-21)27(26(23)24-15-16-31(4)30-24)19-9-11-20(12-10-19)29-28(33)35-18(2)3;1-5-33-22-13-14-23-24(15-22)31(21-7-6-8-21)26(25(23)27-29-18(4)16-34-27)19-9-11-20(12-10-19)30-28(32)35-17(2)3;1-5-33-22-13-14-23-24(15-22)31(21-7-6-8-21)26(25(23)27-18(4)16-29-35-27)19-9-11-20(12-10-19)30-28(32)34-17(2)3;1-4-33-22-14-15-23-25(17-22)31(21-7-5-8-21)27(26(23)24-9-6-16-29-24)19-10-12-20(13-11-19)30-28(32)34-18(2)3;1-4-32-21-12-13-22-23(14-21)30(20-6-5-7-20)26(25(22)24-15-28-16-33-24)18-8-10-19(11-9-18)29-27(31)34-17(2)3/h10-18,22H,6-9H2,1-5H3,(H,30,34);9-15,17-18,22H,5-8,16H2,1-4H3,(H,31,33);7-12,15,17-19,22H,2-6,13-14H2,1H3,(H,32,36);7-13,15-18,21H,2-6H2,1H3,(H,33,35);7-13,16-18,21H,2-6,15H2,1H3,(H,32,35)(H,30,31,33);9-18,21H,5-8H2,1-4H3,(H,29,33);2*9-17,21H,5-8H2,1-4H3,(H,30,32);6,9-15,17-18,21H,4-5,7-8,16H2,1-3H3,(H,30,32);8-17,20H,4-7H2,1-3H3,(H,29,31).
What are the key properties of 1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate?
1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate has a molecular weight of 4797.78 g/mol, XLogP of 67.02, 73 rotatable bonds, 11 hydrogen bond donors, and 64 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-[2-(tetrazol-2-yl)ethoxy]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1,3,5-triazin-2-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,2-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1-methylpyrazol-3-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(4-methyl-2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-oxazol-5-yl)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-pyrrol-5-yl)indol-2-yl]phenyl]carbamate is sourced from PubChem (CID 160783811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).