N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutylindol-2-yl)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropyl-2-[4-(propan-2-ylamino)phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]carbamate

C157H148F3N23O13S2 — CID 162216521

About N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutylindol-2-yl)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropyl-2-[4-(propan-2-ylamino)phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]carbamate

N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutylindol-2-yl)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropyl-2-[4-(propan-2-ylamino)phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]carbamate (PubChem CID 162216521) has the molecular formula C157H148F3N23O13S2 and a molecular weight of 2686.19 g/mol. Its IUPAC name is N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutylindol-2-yl)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropyl-2-[4-(propan-2-ylamino)phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]carbamate.

Molecular Properties

• Compound Name: N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutylindol-2-yl)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropyl-2-[4-(propan-2-ylamino)phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]carbamate
• PubChem CID: 162216521
• Molecular Formula: C157H148F3N23O13S2
• Molecular Weight: 2686.19 g/mol
• Exact Mass: 2684.10
• IUPAC Name: N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutylindol-2-yl)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropyl-2-[4-(propan-2-ylamino)phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]carbamate
• SMILES: CC(C)CS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ccccn4)cc3n2C2CCC2)cc1.CC(C)Nc1ccc(-c2c(C#N)c3ccc(Oc4ncccn4)cc3n2C2CC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ccccn4)cc3n2C2CCC2)cc1.C[C@@H](OC(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ncco4)cc3n2C2CCC2)cc1)C1CC1.C[C@@H](OC(=O)Nc1ccc(-c2c(C#N)c3ccccc3n2C2CCC2)cc1)C1CC1.N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(C2CC2)c2cc(OCC(F)(F)F)ccc12
• InChI: InChI=1S/C28H26N4O3.C28H28N4O2S.C28H26N4O2.C25H23N5O.C25H25N3O2.C23H20F3N3O3S/c1-17(18-5-6-18)35-28(33)31-21-10-7-19(8-11-21)26-24(16-29)23-12-9-20(27-30-13-14-34-27)15-25(23)32(26)22-3-2-4-22;1-19(2)18-35(33,34)31-22-12-9-20(10-13-22)28-25(17-29)24-14-11-21(26-8-3-4-15-30-26)16-27(24)32(28)23-6-5-7-23;1-18(2)34-28(33)31-21-12-9-19(10-13-21)27-24(17-29)23-14-11-20(25-8-3-4-15-30-25)16-26(23)32(27)22-6-5-7-22;1-16(2)29-18-6-4-17(5-7-18)24-22(15-26)21-11-10-20(31-25-27-12-3-13-28-25)14-23(21)30(24)19-8-9-19;1-16(17-9-10-17)30-25(29)27-19-13-11-18(12-14-19)24-22(15-26)21-7-2-3-8-23(21)28(24)20-5-4-6-20;24-23(25,26)13-32-17-7-10-19-20(12-27)22(29(16-5-6-16)21(19)11-17)14-1-3-15(4-2-14)28-33(30,31)18-8-9-18/h7-15,17-18,22H,2-6H2,1H3,(H,31,33);3-4,8-16,19,23,31H,5-7,18H2,1-2H3;3-4,8-16,18,22H,5-7H2,1-2H3,(H,31,33);3-7,10-14,16,19,29H,8-9H2,1-2H3;2-3,7-8,11-14,16-17,20H,4-6,9-10H2,1H3,(H,27,29);1-4,7,10-11,16,18,28H,5-6,8-9,13H2/t17-;;;;16-;/m1...1./s1
• InChIKey: ZTNREMPXLCFOBK-ZUKDPGHBSA-N
• XLogP: 37.73
• TPSA: 487.73 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 31
• Rotatable Bonds: 36
• Heavy Atoms: 198
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2686.19
LogP ≤ 5	37.73
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	31

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-pyridin-2-ylindol-2-yl)phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutylindol-2-yl)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropyl-2-[4-(propan-2-ylamino)phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]carbamate?

The IUPAC name of N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutylindol-2-yl)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropyl-2-[4-(propan-2-ylamino)phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]carbamate (CID 162216521) is N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutylindol-2-yl)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropyl-2-[4-(propan-2-ylamino)phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]carbamate.

What is the SMILES notation for N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutylindol-2-yl)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropyl-2-[4-(propan-2-ylamino)phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]carbamate?

The canonical SMILES for N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutylindol-2-yl)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropyl-2-[4-(propan-2-ylamino)phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]carbamate is CC(C)CS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ccccn4)cc3n2C2CCC2)cc1.CC(C)Nc1ccc(-c2c(C#N)c3ccc(Oc4ncccn4)cc3n2C2CC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ccccn4)cc3n2C2CCC2)cc1.C[C@@H](OC(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ncco4)cc3n2C2CCC2)cc1)C1CC1.C[C@@H](OC(=O)Nc1ccc(-c2c(C#N)c3ccccc3n2C2CCC2)cc1)C1CC1.N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(C2CC2)c2cc(OCC(F)(F)F)ccc12.

What is the InChIKey of N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutylindol-2-yl)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropyl-2-[4-(propan-2-ylamino)phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]carbamate?

The InChIKey is ZTNREMPXLCFOBK-ZUKDPGHBSA-N. The full InChI is InChI=1S/C28H26N4O3.C28H28N4O2S.C28H26N4O2.C25H23N5O.C25H25N3O2.C23H20F3N3O3S/c1-17(18-5-6-18)35-28(33)31-21-10-7-19(8-11-21)26-24(16-29)23-12-9-20(27-30-13-14-34-27)15-25(23)32(26)22-3-2-4-22;1-19(2)18-35(33,34)31-22-12-9-20(10-13-22)28-25(17-29)24-14-11-21(26-8-3-4-15-30-26)16-27(24)32(28)23-6-5-7-23;1-18(2)34-28(33)31-21-12-9-19(10-13-21)27-24(17-29)23-14-11-20(25-8-3-4-15-30-25)16-26(23)32(27)22-6-5-7-22;1-16(2)29-18-6-4-17(5-7-18)24-22(15-26)21-11-10-20(31-25-27-12-3-13-28-25)14-23(21)30(24)19-8-9-19;1-16(17-9-10-17)30-25(29)27-19-13-11-18(12-14-19)24-22(15-26)21-7-2-3-8-23(21)28(24)20-5-4-6-20;24-23(25,26)13-32-17-7-10-19-20(12-27)22(29(16-5-6-16)21(19)11-17)14-1-3-15(4-2-14)28-33(30,31)18-8-9-18/h7-15,17-18,22H,2-6H2,1H3,(H,31,33);3-4,8-16,19,23,31H,5-7,18H2,1-2H3;3-4,8-16,18,22H,5-7H2,1-2H3,(H,31,33);3-7,10-14,16,19,29H,8-9H2,1-2H3;2-3,7-8,11-14,16-17,20H,4-6,9-10H2,1H3,(H,27,29);1-4,7,10-11,16,18,28H,5-6,8-9,13H2/t17-;;;;16-;/m1...1./s1.

What are the key properties of N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutylindol-2-yl)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropyl-2-[4-(propan-2-ylamino)phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]carbamate?

N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutylindol-2-yl)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropyl-2-[4-(propan-2-ylamino)phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]carbamate has a molecular weight of 2686.19 g/mol, XLogP of 37.73, 36 rotatable bonds, 6 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutylindol-2-yl)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-oxazol-2-yl)indol-2-yl]phenyl]carbamate;1-cyclopropyl-2-[4-(propan-2-ylamino)phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyridin-2-ylindol-2-yl)phenyl]carbamate is sourced from PubChem (CID 162216521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).