N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea

C109H113F3N18O11S2 — CID 159427272

About N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea

N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea (PubChem CID 159427272) has the molecular formula C109H113F3N18O11S2 and a molecular weight of 1972.35 g/mol. Its IUPAC name is N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea.

Molecular Properties

• Compound Name: N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea
• PubChem CID: 159427272
• Molecular Formula: C109H113F3N18O11S2
• Molecular Weight: 1972.35 g/mol
• Exact Mass: 1970.82
• IUPAC Name: N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea
• SMILES: C=CCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CCC)cc1.CCCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CCC)cc1.CCCn1c(-c2ccc(NC(=O)NCC)cc2)c(C#N)c2cc(OC)ccc21.CCCn1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)c(C#N)c2cc(OC)ccc21.CCn1c(-c2ccc(NS(C)(=O)=O)cc2)c(C#N)c2ccc(C(F)(F)F)cc21
• InChI: InChI=1S/C23H26N4O2.C23H24N4O2.C22H24N4O2.C22H23N3O3S.C19H16F3N3O2S/c2*1-4-12-25-23(28)26-17-8-6-16(7-9-17)22-20(15-24)19-14-18(29-3)10-11-21(19)27(22)13-5-2;1-4-12-26-20-11-10-17(28-3)13-18(20)19(14-23)21(26)15-6-8-16(9-7-15)25-22(27)24-5-2;1-3-12-25-21-11-8-17(28-2)13-19(21)20(14-23)22(25)15-4-6-16(7-5-15)24-29(26,27)18-9-10-18;1-3-25-17-10-13(19(20,21)22)6-9-15(17)16(11-23)18(25)12-4-7-14(8-5-12)24-28(2,26)27/h6-11,14H,4-5,12-13H2,1-3H3,(H2,25,26,28);4,6-11,14H,1,5,12-13H2,2-3H3,(H2,25,26,28);6-11,13H,4-5,12H2,1-3H3,(H2,24,25,27);4-8,11,13,18,24H,3,9-10,12H2,1-2H3;4-10,24H,3H2,1-2H3
• InChIKey: LQNHNRPYFNVMNI-UHFFFAOYSA-N
• XLogP: 23.87
• TPSA: 396.25 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 21
• Rotatable Bonds: 31
• Heavy Atoms: 143
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1972.35
LogP ≤ 5	23.87
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea?

The IUPAC name of N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea (CID 159427272) is N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea.

What is the SMILES notation for N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea?

The canonical SMILES for N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea is C=CCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CCC)cc1.CCCNC(=O)Nc1ccc(-c2c(C#N)c3cc(OC)ccc3n2CCC)cc1.CCCn1c(-c2ccc(NC(=O)NCC)cc2)c(C#N)c2cc(OC)ccc21.CCCn1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)c(C#N)c2cc(OC)ccc21.CCn1c(-c2ccc(NS(C)(=O)=O)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.

What is the InChIKey of N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea?

The InChIKey is LQNHNRPYFNVMNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2.C23H24N4O2.C22H24N4O2.C22H23N3O3S.C19H16F3N3O2S/c2*1-4-12-25-23(28)26-17-8-6-16(7-9-17)22-20(15-24)19-14-18(29-3)10-11-21(19)27(22)13-5-2;1-4-12-26-20-11-10-17(28-3)13-18(20)19(14-23)21(26)15-6-8-16(9-7-15)25-22(27)24-5-2;1-3-12-25-21-11-8-17(28-2)13-19(21)20(14-23)22(25)15-4-6-16(7-5-15)24-29(26,27)18-9-10-18;1-3-25-17-10-13(19(20,21)22)6-9-15(17)16(11-23)18(25)12-4-7-14(8-5-12)24-28(2,26)27/h6-11,14H,4-5,12-13H2,1-3H3,(H2,25,26,28);4,6-11,14H,1,5,12-13H2,2-3H3,(H2,25,26,28);6-11,13H,4-5,12H2,1-3H3,(H2,24,25,27);4-8,11,13,18,24H,3,9-10,12H2,1-2H3;4-10,24H,3H2,1-2H3.

What are the key properties of N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea?

N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea has a molecular weight of 1972.35 g/mol, XLogP of 23.87, 31 rotatable bonds, 8 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-ethylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-prop-2-enylurea;1-[4-(3-cyano-5-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea is sourced from PubChem (CID 159427272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).