propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate

C228H277N27O34 — CID 157096562

IUPACpropan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate
SMILESCC(C)OC(=O)Nc1ccc(-c2c(C=NN(C)C)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(N(C)C)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(NC(=O)C3CC3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c([N+](=O)[O-])c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CCOc1ccc2c(C=NN(C)C)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(N(C)C)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(NC(=O)C3CC3)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.Cc1nnc(-c2c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c3cc(OC4CCOCC4)ccc23)o1
InChIInChI=1S/C31H37N3O5.C30H34N4O5.C30H38N4O4.C29H37N3O4.C28H33N3O4.C27H34N4O3.C27H31N3O6.C26H33N3O3/c1-19(2)38-31(36)32-22-10-8-20(9-11-22)29-28(33-30(35)21-6-7-21)26-13-12-25(39-24-14-16-37-17-15-24)18-27(26)34(29)23-4-3-5-23;1-18(2)37-30(35)31-21-9-7-20(8-10-21)28-27(29-33-32-19(3)38-29)25-12-11-24(39-23-13-15-36-16-14-23)17-26(25)34(28)22-5-4-6-22;1-20(2)37-30(35)32-22-10-8-21(9-11-22)29-27(19-31-33(3)4)26-13-12-25(38-24-14-16-36-17-15-24)18-28(26)34(29)23-6-5-7-23;1-19(2)35-29(33)30-21-10-8-20(9-11-21)27-28(31(3)4)25-13-12-24(36-23-14-16-34-17-15-23)18-26(25)32(27)22-6-5-7-22;1-4-34-22-14-15-23-24(16-22)31(21-6-5-7-21)26(25(23)30-27(32)19-8-9-19)18-10-12-20(13-11-18)29-28(33)35-17(2)3;1-6-33-22-14-15-23-24(17-28-30(4)5)26(31(25(23)16-22)21-8-7-9-21)19-10-12-20(13-11-19)29-27(32)34-18(2)3;1-17(2)35-27(31)28-19-8-6-18(7-9-19)25-26(30(32)33)23-11-10-22(36-21-12-14-34-15-13-21)16-24(23)29(25)20-4-3-5-20;1-6-31-21-14-15-22-23(16-21)29(20-8-7-9-20)24(25(22)28(4)5)18-10-12-19(13-11-18)27-26(30)32-17(2)3/h8-13,18-19,21,23-24H,3-7,14-17H2,1-2H3,(H,32,36)(H,33,35);7-12,17-18,22-23H,4-6,13-16H2,1-3H3,(H,31,35);8-13,18-20,23-24H,5-7,14-17H2,1-4H3,(H,32,35);8-13,18-19,22-23H,5-7,14-17H2,1-4H3,(H,30,33);10-17,19,21H,4-9H2,1-3H3,(H,29,33)(H,30,32);10-18,21H,6-9H2,1-5H3,(H,29,32);6-11,16-17,20-21H,3-5,12-15H2,1-2H3,(H,28,31);10-17,20H,6-9H2,1-5H3,(H,27,30)
InChIKeyAFGWLAFJYFUADG-UHFFFAOYSA-N
MW3939.88 g/mol
LogP52.79
Rot. Bonds60

About propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate

propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate (PubChem CID 157096562) has the molecular formula C228H277N27O34 and a molecular weight of 3939.88 g/mol. Its IUPAC name is propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate.

Molecular Properties

Compound Namepropan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate
PubChem CID157096562
Molecular FormulaC228H277N27O34
Molecular Weight3939.88 g/mol
Exact Mass3937.08
IUPAC Namepropan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate
SMILESCC(C)OC(=O)Nc1ccc(-c2c(C=NN(C)C)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(N(C)C)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(NC(=O)C3CC3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c([N+](=O)[O-])c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CCOc1ccc2c(C=NN(C)C)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(N(C)C)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(NC(=O)C3CC3)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.Cc1nnc(-c2c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c3cc(OC4CCOCC4)ccc23)o1
InChIInChI=1S/C31H37N3O5.C30H34N4O5.C30H38N4O4.C29H37N3O4.C28H33N3O4.C27H34N4O3.C27H31N3O6.C26H33N3O3/c1-19(2)38-31(36)32-22-10-8-20(9-11-22)29-28(33-30(35)21-6-7-21)26-13-12-25(39-24-14-16-37-17-15-24)18-27(26)34(29)23-4-3-5-23;1-18(2)37-30(35)31-21-9-7-20(8-10-21)28-27(29-33-32-19(3)38-29)25-12-11-24(39-23-13-15-36-16-14-23)17-26(25)34(28)22-5-4-6-22;1-20(2)37-30(35)32-22-10-8-21(9-11-22)29-27(19-31-33(3)4)26-13-12-25(38-24-14-16-36-17-15-24)18-28(26)34(29)23-6-5-7-23;1-19(2)35-29(33)30-21-10-8-20(9-11-21)27-28(31(3)4)25-13-12-24(36-23-14-16-34-17-15-23)18-26(25)32(27)22-6-5-7-22;1-4-34-22-14-15-23-24(16-22)31(21-6-5-7-21)26(25(23)30-27(32)19-8-9-19)18-10-12-20(13-11-18)29-28(33)35-17(2)3;1-6-33-22-14-15-23-24(17-28-30(4)5)26(31(25(23)16-22)21-8-7-9-21)19-10-12-20(13-11-19)29-27(32)34-18(2)3;1-17(2)35-27(31)28-19-8-6-18(7-9-19)25-26(30(32)33)23-11-10-22(36-21-12-14-34-15-13-21)16-24(23)29(25)20-4-3-5-20;1-6-31-21-14-15-22-23(16-21)29(20-8-7-9-20)24(25(22)28(4)5)18-10-12-19(13-11-18)27-26(30)32-17(2)3/h8-13,18-19,21,23-24H,3-7,14-17H2,1-2H3,(H,32,36)(H,33,35);7-12,17-18,22-23H,4-6,13-16H2,1-3H3,(H,31,35);8-13,18-20,23-24H,5-7,14-17H2,1-4H3,(H,32,35);8-13,18-19,22-23H,5-7,14-17H2,1-4H3,(H,30,33);10-17,19,21H,4-9H2,1-3H3,(H,29,33)(H,30,32);10-18,21H,6-9H2,1-5H3,(H,29,32);6-11,16-17,20-21H,3-5,12-15H2,1-2H3,(H,28,31);10-17,20H,6-9H2,1-5H3,(H,27,30)
InChIKeyAFGWLAFJYFUADG-UHFFFAOYSA-N
XLogP52.79
TPSA644.01 Ų
H-Bond Donors10
H-Bond Acceptors50
Rotatable Bonds60
Heavy Atoms289
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003939.88
LogP ≤ 552.79
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1050

Analyze propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)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

Related Compounds

Frequently Asked Questions

What is the IUPAC name of propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate?
The IUPAC name of propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate (CID 157096562) is propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate.
What is the SMILES notation for propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate?
The canonical SMILES for propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate is CC(C)OC(=O)Nc1ccc(-c2c(C=NN(C)C)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(N(C)C)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(NC(=O)C3CC3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c([N+](=O)[O-])c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CCOc1ccc2c(C=NN(C)C)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(N(C)C)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(NC(=O)C3CC3)c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c2c1.Cc1nnc(-c2c(-c3ccc(NC(=O)OC(C)C)cc3)n(C3CCC3)c3cc(OC4CCOCC4)ccc23)o1.
What is the InChIKey of propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate?
The InChIKey is AFGWLAFJYFUADG-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H37N3O5.C30H34N4O5.C30H38N4O4.C29H37N3O4.C28H33N3O4.C27H34N4O3.C27H31N3O6.C26H33N3O3/c1-19(2)38-31(36)32-22-10-8-20(9-11-22)29-28(33-30(35)21-6-7-21)26-13-12-25(39-24-14-16-37-17-15-24)18-27(26)34(29)23-4-3-5-23;1-18(2)37-30(35)31-21-9-7-20(8-10-21)28-27(29-33-32-19(3)38-29)25-12-11-24(39-23-13-15-36-16-14-23)17-26(25)34(28)22-5-4-6-22;1-20(2)37-30(35)32-22-10-8-21(9-11-22)29-27(19-31-33(3)4)26-13-12-25(38-24-14-16-36-17-15-24)18-28(26)34(29)23-6-5-7-23;1-19(2)35-29(33)30-21-10-8-20(9-11-21)27-28(31(3)4)25-13-12-24(36-23-14-16-34-17-15-23)18-26(25)32(27)22-6-5-7-22;1-4-34-22-14-15-23-24(16-22)31(21-6-5-7-21)26(25(23)30-27(32)19-8-9-19)18-10-12-20(13-11-18)29-28(33)35-17(2)3;1-6-33-22-14-15-23-24(17-28-30(4)5)26(31(25(23)16-22)21-8-7-9-21)19-10-12-20(13-11-19)29-27(32)34-18(2)3;1-17(2)35-27(31)28-19-8-6-18(7-9-19)25-26(30(32)33)23-11-10-22(36-21-12-14-34-15-13-21)16-24(23)29(25)20-4-3-5-20;1-6-31-21-14-15-22-23(16-21)29(20-8-7-9-20)24(25(22)28(4)5)18-10-12-19(13-11-18)27-26(30)32-17(2)3/h8-13,18-19,21,23-24H,3-7,14-17H2,1-2H3,(H,32,36)(H,33,35);7-12,17-18,22-23H,4-6,13-16H2,1-3H3,(H,31,35);8-13,18-20,23-24H,5-7,14-17H2,1-4H3,(H,32,35);8-13,18-19,22-23H,5-7,14-17H2,1-4H3,(H,30,33);10-17,19,21H,4-9H2,1-3H3,(H,29,33)(H,30,32);10-18,21H,6-9H2,1-5H3,(H,29,32);6-11,16-17,20-21H,3-5,12-15H2,1-2H3,(H,28,31);10-17,20H,6-9H2,1-5H3,(H,27,30).
What are the key properties of propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate?
propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate has a molecular weight of 3939.88 g/mol, XLogP of 52.79, 60 rotatable bonds, 10 hydrogen bond donors, and 50 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(cyclopropanecarbonylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(dimethylamino)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-ethoxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-[(dimethylhydrazinylidene)methyl]-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-nitro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate is sourced from PubChem (CID 157096562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).