N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,5-dimethylphenyl]propane-1-sulfonamide;1-cyclopropylethyl N-[2-chloro-4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]-2-fluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-3-methylphenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate

C168H166ClF5N22O18S — CID 159984046

About N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,5-dimethylphenyl]propane-1-sulfonamide;1-cyclopropylethyl N-[2-chloro-4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]-2-fluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-3-methylphenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate

N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,5-dimethylphenyl]propane-1-sulfonamide;1-cyclopropylethyl N-[2-chloro-4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]-2-fluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-3-methylphenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate (PubChem CID 159984046) has the molecular formula C168H166ClF5N22O18S and a molecular weight of 2943.82 g/mol. Its IUPAC name is N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,5-dimethylphenyl]propane-1-sulfonamide;1-cyclopropylethyl N-[2-chloro-4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]-2-fluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-3-methylphenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate.

Molecular Properties

• Compound Name: N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,5-dimethylphenyl]propane-1-sulfonamide;1-cyclopropylethyl N-[2-chloro-4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]-2-fluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-3-methylphenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate
• PubChem CID: 159984046
• Molecular Formula: C168H166ClF5N22O18S
• Molecular Weight: 2943.82 g/mol
• Exact Mass: 2941.21
• IUPAC Name: N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,5-dimethylphenyl]propane-1-sulfonamide;1-cyclopropylethyl N-[2-chloro-4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]-2-fluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-3-methylphenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate
• SMILES: CC(C)OC(=O)Nc1ccc(-c2cc3ccc(Oc4ccccn4)cc3n2CC2CC2)cc1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCC(F)F)cc3n2C2CCC2)cc1Cl)C1CC1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCC(F)F)cc3n2C2CCC2)cc1F)C1CC1.CCCS(=O)(=O)Nc1cc(C)c(-c2c(C#N)c3ccc(Oc4ncccn4)cc3n2C2CCC2)cc1C.C[C@@H](OC(=O)Nc1ccc(-c2cc3ccc(Oc4ccccn4)cc3n2CC2CC2)cc1)C1CC1.Cc1cc(NC(=O)O[C@H](C)C2CC2)ccc1-c1c(C#N)c2ccc(Oc3ncccn3)cc2n1C1CCC1
• InChI: InChI=1S/C30H29N5O3.C29H29N3O3.C28H29N5O3S.C27H26ClF2N3O3.C27H26F3N3O3.C27H27N3O3/c1-18-15-21(34-30(36)37-19(2)20-7-8-20)9-11-24(18)28-26(17-31)25-12-10-23(38-29-32-13-4-14-33-29)16-27(25)35(28)22-5-3-6-22;1-19(21-7-8-21)34-29(33)31-24-12-9-22(10-13-24)26-16-23-11-14-25(35-28-4-2-3-15-30-28)17-27(23)32(26)18-20-5-6-20;1-4-13-37(34,35)32-25-15-18(2)23(14-19(25)3)27-24(17-29)22-10-9-21(36-28-30-11-6-12-31-28)16-26(22)33(27)20-7-5-8-20;2*1-15(16-5-6-16)36-27(34)32-23-10-7-17(11-22(23)28)26-21(13-31)20-9-8-19(35-14-25(29)30)12-24(20)33(26)18-3-2-4-18;1-18(2)32-27(31)29-22-11-8-20(9-12-22)24-15-21-10-13-23(33-26-5-3-4-14-28-26)16-25(21)30(24)17-19-6-7-19/h4,9-16,19-20,22H,3,5-8H2,1-2H3,(H,34,36);2-4,9-17,19-21H,5-8,18H2,1H3,(H,31,33);6,9-12,14-16,20,32H,4-5,7-8,13H2,1-3H3;2*7-12,15-16,18,25H,2-6,14H2,1H3,(H,32,34);3-5,8-16,18-19H,6-7,17H2,1-2H3,(H,29,31)/t2*19-;;;;/m11..../s1
• InChIKey: OGCLNDNTVUSAAP-SJKBYSAMSA-N
• XLogP: 42.10
• TPSA: 495.28 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 34
• Rotatable Bonds: 46
• Heavy Atoms: 215
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2943.82
LogP ≤ 5	42.10
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,5-dimethylphenyl]propane-1-sulfonamide;1-cyclopropylethyl N-[2-chloro-4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]-2-fluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-3-methylphenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate?

The IUPAC name of N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,5-dimethylphenyl]propane-1-sulfonamide;1-cyclopropylethyl N-[2-chloro-4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]-2-fluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-3-methylphenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate (CID 159984046) is N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,5-dimethylphenyl]propane-1-sulfonamide;1-cyclopropylethyl N-[2-chloro-4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]-2-fluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-3-methylphenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate.

What is the SMILES notation for N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,5-dimethylphenyl]propane-1-sulfonamide;1-cyclopropylethyl N-[2-chloro-4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]-2-fluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-3-methylphenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate?

The canonical SMILES for N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,5-dimethylphenyl]propane-1-sulfonamide;1-cyclopropylethyl N-[2-chloro-4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]-2-fluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-3-methylphenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate is CC(C)OC(=O)Nc1ccc(-c2cc3ccc(Oc4ccccn4)cc3n2CC2CC2)cc1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCC(F)F)cc3n2C2CCC2)cc1Cl)C1CC1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCC(F)F)cc3n2C2CCC2)cc1F)C1CC1.CCCS(=O)(=O)Nc1cc(C)c(-c2c(C#N)c3ccc(Oc4ncccn4)cc3n2C2CCC2)cc1C.C[C@@H](OC(=O)Nc1ccc(-c2cc3ccc(Oc4ccccn4)cc3n2CC2CC2)cc1)C1CC1.Cc1cc(NC(=O)O[C@H](C)C2CC2)ccc1-c1c(C#N)c2ccc(Oc3ncccn3)cc2n1C1CCC1.

What is the InChIKey of N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,5-dimethylphenyl]propane-1-sulfonamide;1-cyclopropylethyl N-[2-chloro-4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]-2-fluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-3-methylphenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate?

The InChIKey is OGCLNDNTVUSAAP-SJKBYSAMSA-N. The full InChI is InChI=1S/C30H29N5O3.C29H29N3O3.C28H29N5O3S.C27H26ClF2N3O3.C27H26F3N3O3.C27H27N3O3/c1-18-15-21(34-30(36)37-19(2)20-7-8-20)9-11-24(18)28-26(17-31)25-12-10-23(38-29-32-13-4-14-33-29)16-27(25)35(28)22-5-3-6-22;1-19(21-7-8-21)34-29(33)31-24-12-9-22(10-13-24)26-16-23-11-14-25(35-28-4-2-3-15-30-28)17-27(23)32(26)18-20-5-6-20;1-4-13-37(34,35)32-25-15-18(2)23(14-19(25)3)27-24(17-29)22-10-9-21(36-28-30-11-6-12-31-28)16-26(22)33(27)20-7-5-8-20;2*1-15(16-5-6-16)36-27(34)32-23-10-7-17(11-22(23)28)26-21(13-31)20-9-8-19(35-14-25(29)30)12-24(20)33(26)18-3-2-4-18;1-18(2)32-27(31)29-22-11-8-20(9-12-22)24-15-21-10-13-23(33-26-5-3-4-14-28-26)16-25(21)30(24)17-19-6-7-19/h4,9-16,19-20,22H,3,5-8H2,1-2H3,(H,34,36);2-4,9-17,19-21H,5-8,18H2,1H3,(H,31,33);6,9-12,14-16,20,32H,4-5,7-8,13H2,1-3H3;2*7-12,15-16,18,25H,2-6,14H2,1H3,(H,32,34);3-5,8-16,18-19H,6-7,17H2,1-2H3,(H,29,31)/t2*19-;;;;/m11..../s1.

What are the key properties of N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,5-dimethylphenyl]propane-1-sulfonamide;1-cyclopropylethyl N-[2-chloro-4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]-2-fluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-3-methylphenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate?

N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,5-dimethylphenyl]propane-1-sulfonamide;1-cyclopropylethyl N-[2-chloro-4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]-2-fluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-3-methylphenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate has a molecular weight of 2943.82 g/mol, XLogP of 42.10, 46 rotatable bonds, 6 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,5-dimethylphenyl]propane-1-sulfonamide;1-cyclopropylethyl N-[2-chloro-4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclobutyl-6-(2,2-difluoroethoxy)indol-2-yl]-2-fluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-3-methylphenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-(cyclopropylmethyl)-6-pyridin-2-yloxyindol-2-yl]phenyl]carbamate is sourced from PubChem (CID 159984046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).