N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide

C112H127N17O15S6 — CID 162132608

IUPACN-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide
SMILESCCCn1c(-c2ccc(N(C)S(C)(=O)=O)cc2)c(C#N)c2ccc(OC)cc21.CCS(=O)(=O)N(C)c1ccc(-c2c(C#N)c3ccc(OC)cc3n2C)cc1.CCn1c(-c2ccc(N(C)S(=O)(=O)CCN3CCCC3)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(N(C)S(=O)(=O)CCN3CCSCC3)cc2)c(C#N)c2ccc(OC)cc21.COc1ccc2c(C#N)c(-c3ccc(N(C)S(C)(=O)=O)cc3)n(C(C)C)c2c1
InChIInChI=1S/C25H30N4O3S2.C25H30N4O3S.2C21H23N3O3S.C20H21N3O3S/c1-4-29-24-17-21(32-3)9-10-22(24)23(18-26)25(29)19-5-7-20(8-6-19)27(2)34(30,31)16-13-28-11-14-33-15-12-28;1-4-29-24-17-21(32-3)11-12-22(24)23(18-26)25(29)19-7-9-20(10-8-19)27(2)33(30,31)16-15-28-13-5-6-14-28;1-14(2)24-20-12-17(27-4)10-11-18(20)19(13-22)21(24)15-6-8-16(9-7-15)23(3)28(5,25)26;1-5-12-24-20-13-17(27-3)10-11-18(20)19(14-22)21(24)15-6-8-16(9-7-15)23(2)28(4,25)26;1-5-27(24,25)23(3)15-8-6-14(7-9-15)20-18(13-21)17-11-10-16(26-4)12-19(17)22(20)2/h5-10,17H,4,11-16H2,1-3H3;7-12,17H,4-6,13-16H2,1-3H3;6-12,14H,1-5H3;6-11,13H,5,12H2,1-4H3;6-12H,5H2,1-4H3
InChIKeyZIVZWOALMOTLIT-UHFFFAOYSA-N
MW2143.75 g/mol
LogP19.76
Rot. Bonds32

About N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide

N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide (PubChem CID 162132608) has the molecular formula C112H127N17O15S6 and a molecular weight of 2143.75 g/mol. Its IUPAC name is N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide.

Molecular Properties

Compound NameN-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide
PubChem CID162132608
Molecular FormulaC112H127N17O15S6
Molecular Weight2143.75 g/mol
Exact Mass2141.80
IUPAC NameN-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide
SMILESCCCn1c(-c2ccc(N(C)S(C)(=O)=O)cc2)c(C#N)c2ccc(OC)cc21.CCS(=O)(=O)N(C)c1ccc(-c2c(C#N)c3ccc(OC)cc3n2C)cc1.CCn1c(-c2ccc(N(C)S(=O)(=O)CCN3CCCC3)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(N(C)S(=O)(=O)CCN3CCSCC3)cc2)c(C#N)c2ccc(OC)cc21.COc1ccc2c(C#N)c(-c3ccc(N(C)S(C)(=O)=O)cc3)n(C(C)C)c2c1
InChIInChI=1S/C25H30N4O3S2.C25H30N4O3S.2C21H23N3O3S.C20H21N3O3S/c1-4-29-24-17-21(32-3)9-10-22(24)23(18-26)25(29)19-5-7-20(8-6-19)27(2)34(30,31)16-13-28-11-14-33-15-12-28;1-4-29-24-17-21(32-3)11-12-22(24)23(18-26)25(29)19-7-9-20(10-8-19)27(2)33(30,31)16-15-28-13-5-6-14-28;1-14(2)24-20-12-17(27-4)10-11-18(20)19(13-22)21(24)15-6-8-16(9-7-15)23(3)28(5,25)26;1-5-12-24-20-13-17(27-3)10-11-18(20)19(14-22)21(24)15-6-8-16(9-7-15)23(2)28(4,25)26;1-5-27(24,25)23(3)15-8-6-14(7-9-15)20-18(13-21)17-11-10-16(26-4)12-19(17)22(20)2/h5-10,17H,4,11-16H2,1-3H3;7-12,17H,4-6,13-16H2,1-3H3;6-12,14H,1-5H3;6-11,13H,5,12H2,1-4H3;6-12H,5H2,1-4H3
InChIKeyZIVZWOALMOTLIT-UHFFFAOYSA-N
XLogP19.76
TPSA383.13 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds32
Heavy Atoms150
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002143.75
LogP ≤ 519.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

Analyze N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide with MolForge

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Related Compounds

N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methylmethanesulfonamide
CID 59425065
N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide
CID 58694320
N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-2-thiomorpholin-4-ylethanesulfonamide
CID 58693906
N-[4-(3-cyano-1-hexyl-6-methoxyindol-2-yl)phenyl]-N-methylmethanesulfonamide
CID 143184513
N-[4-[3-cyano-1-methyl-6-(trifluoromethoxy)indol-2-yl]phenyl]-N-methylethanesulfonamide
CID 58724749
N-[[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]methyl]-2-morpholin-4-ylethanesulfonamide
CID 66866350
N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]methanesulfonamide
CID 58694414
N-[4-(1-butyl-3-cyano-6-methoxyindol-2-yl)phenyl]ethanesulfonamide;N-[4-(1-butyl-3-cyano-6-methoxyindol-2-yl)phenyl]methanesulfonamide;2-[3-(2-chloroethylsulfamoylamino)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;2-[3-(1,1-dioxo-1,2,5-thiadiazolidin-2-yl)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-ethyl-6-(2-fluoroethoxy)indole-3-carbonitrile
CID 159956786
2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate
CID 59426351
N-[[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]methyl]-N-methylmethanesulfonamide
CID 58693961
N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-ethylmethanesulfinamide
CID 143184867
N-[4-(1-butyl-3-cyano-6-methoxyindol-2-yl)phenyl]propane-2-sulfonamide
CID 58694504

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide?
The IUPAC name of N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide (CID 162132608) is N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide.
What is the SMILES notation for N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide?
The canonical SMILES for N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide is CCCn1c(-c2ccc(N(C)S(C)(=O)=O)cc2)c(C#N)c2ccc(OC)cc21.CCS(=O)(=O)N(C)c1ccc(-c2c(C#N)c3ccc(OC)cc3n2C)cc1.CCn1c(-c2ccc(N(C)S(=O)(=O)CCN3CCCC3)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(N(C)S(=O)(=O)CCN3CCSCC3)cc2)c(C#N)c2ccc(OC)cc21.COc1ccc2c(C#N)c(-c3ccc(N(C)S(C)(=O)=O)cc3)n(C(C)C)c2c1.
What is the InChIKey of N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide?
The InChIKey is ZIVZWOALMOTLIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N4O3S2.C25H30N4O3S.2C21H23N3O3S.C20H21N3O3S/c1-4-29-24-17-21(32-3)9-10-22(24)23(18-26)25(29)19-5-7-20(8-6-19)27(2)34(30,31)16-13-28-11-14-33-15-12-28;1-4-29-24-17-21(32-3)11-12-22(24)23(18-26)25(29)19-7-9-20(10-8-19)27(2)33(30,31)16-15-28-13-5-6-14-28;1-14(2)24-20-12-17(27-4)10-11-18(20)19(13-22)21(24)15-6-8-16(9-7-15)23(3)28(5,25)26;1-5-12-24-20-13-17(27-3)10-11-18(20)19(14-22)21(24)15-6-8-16(9-7-15)23(2)28(4,25)26;1-5-27(24,25)23(3)15-8-6-14(7-9-15)20-18(13-21)17-11-10-16(26-4)12-19(17)22(20)2/h5-10,17H,4,11-16H2,1-3H3;7-12,17H,4-6,13-16H2,1-3H3;6-12,14H,1-5H3;6-11,13H,5,12H2,1-4H3;6-12H,5H2,1-4H3.
What are the key properties of N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide?
N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide has a molecular weight of 2143.75 g/mol, XLogP of 19.76, 32 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-pyrrolidin-1-ylethanesulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-methyl-2-thiomorpholin-4-ylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-methylindol-2-yl)phenyl]-N-methylethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]-N-methylmethanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-methylmethanesulfonamide is sourced from PubChem (CID 162132608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).