N-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide

C129H113F24N11O25 — CID 173212974

IUPACN-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide
SMILESCCCNC(=O)Cc1c(C)n(C(=O)c2ccc(OC(F)(F)F)cc2)c2cc(F)c(OC)cc12.CCNC(=O)Cc1c(C)n(C(=O)c2ccc(OC(F)(F)F)cc2)c2cc(F)c(OC)cc12.CNC(=O)Cc1c(C)n(C(=O)c2ccc(OC(F)(F)F)cc2)c2cc(F)c(OC)cc12.COc1cc2c(CC(=O)NC(C)C)c(C)n(C(=O)c3ccc(OC(F)(F)F)cc3)c2cc1F.COc1cc2c(CC(=O)O)c(C)n(C(=O)c3ccc(OC(F)(F)F)cc3)c2cc1F.COc1cc2c(CC(N)=O)c(C)n(C(=O)c3ccc(OC(F)(F)F)cc3)c2cc1F
InChIInChI=1S/2C23H22F4N2O4.C22H20F4N2O4.C21H18F4N2O4.C20H16F4N2O4.C20H15F4NO5/c1-12(2)28-21(30)10-16-13(3)29(19-11-18(24)20(32-4)9-17(16)19)22(31)14-5-7-15(8-6-14)33-23(25,26)27;1-4-9-28-21(30)11-16-13(2)29(19-12-18(24)20(32-3)10-17(16)19)22(31)14-5-7-15(8-6-14)33-23(25,26)27;1-4-27-20(29)10-15-12(2)28(18-11-17(23)19(31-3)9-16(15)18)21(30)13-5-7-14(8-6-13)32-22(24,25)26;1-11-14(9-19(28)26-2)15-8-18(30-3)16(22)10-17(15)27(11)20(29)12-4-6-13(7-5-12)31-21(23,24)25;1-10-13(8-18(25)27)14-7-17(29-2)15(21)9-16(14)26(10)19(28)11-3-5-12(6-4-11)30-20(22,23)24;1-10-13(8-18(26)27)14-7-17(29-2)15(21)9-16(14)25(10)19(28)11-3-5-12(6-4-11)30-20(22,23)24/h5-9,11-12H,10H2,1-4H3,(H,28,30);5-8,10,12H,4,9,11H2,1-3H3,(H,28,30);5-9,11H,4,10H2,1-3H3,(H,27,29);4-8,10H,9H2,1-3H3,(H,26,28);3-7,9H,8H2,1-2H3,(H2,25,27);3-7,9H,8H2,1-2H3,(H,26,27)
InChIKeyDWNDHYRRIWYNFB-UHFFFAOYSA-N
MW2673.33 g/mol
LogP25.86
Rot. Bonds34

About N-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide

N-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide (PubChem CID 173212974) has the molecular formula C129H113F24N11O25 and a molecular weight of 2673.33 g/mol. Its IUPAC name is N-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide.

Molecular Properties

Compound NameN-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide
PubChem CID173212974
Molecular FormulaC129H113F24N11O25
Molecular Weight2673.33 g/mol
Exact Mass2671.75
IUPAC NameN-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide
SMILESCCCNC(=O)Cc1c(C)n(C(=O)c2ccc(OC(F)(F)F)cc2)c2cc(F)c(OC)cc12.CCNC(=O)Cc1c(C)n(C(=O)c2ccc(OC(F)(F)F)cc2)c2cc(F)c(OC)cc12.CNC(=O)Cc1c(C)n(C(=O)c2ccc(OC(F)(F)F)cc2)c2cc(F)c(OC)cc12.COc1cc2c(CC(=O)NC(C)C)c(C)n(C(=O)c3ccc(OC(F)(F)F)cc3)c2cc1F.COc1cc2c(CC(=O)O)c(C)n(C(=O)c3ccc(OC(F)(F)F)cc3)c2cc1F.COc1cc2c(CC(N)=O)c(C)n(C(=O)c3ccc(OC(F)(F)F)cc3)c2cc1F
InChIInChI=1S/2C23H22F4N2O4.C22H20F4N2O4.C21H18F4N2O4.C20H16F4N2O4.C20H15F4NO5/c1-12(2)28-21(30)10-16-13(3)29(19-11-18(24)20(32-4)9-17(16)19)22(31)14-5-7-15(8-6-14)33-23(25,26)27;1-4-9-28-21(30)11-16-13(2)29(19-12-18(24)20(32-3)10-17(16)19)22(31)14-5-7-15(8-6-14)33-23(25,26)27;1-4-27-20(29)10-15-12(2)28(18-11-17(23)19(31-3)9-16(15)18)21(30)13-5-7-14(8-6-13)32-22(24,25)26;1-11-14(9-19(28)26-2)15-8-18(30-3)16(22)10-17(15)27(11)20(29)12-4-6-13(7-5-12)31-21(23,24)25;1-10-13(8-18(25)27)14-7-17(29-2)15(21)9-16(14)26(10)19(28)11-3-5-12(6-4-11)30-20(22,23)24;1-10-13(8-18(26)27)14-7-17(29-2)15(21)9-16(14)25(10)19(28)11-3-5-12(6-4-11)30-20(22,23)24/h5-9,11-12H,10H2,1-4H3,(H,28,30);5-8,10,12H,4,9,11H2,1-3H3,(H,28,30);5-9,11H,4,10H2,1-3H3,(H,27,29);4-8,10H,9H2,1-3H3,(H,26,28);3-7,9H,8H2,1-2H3,(H2,25,27);3-7,9H,8H2,1-2H3,(H,26,27)
InChIKeyDWNDHYRRIWYNFB-UHFFFAOYSA-N
XLogP25.86
TPSA439.55 Ų
H-Bond Donors6
H-Bond Acceptors30
Rotatable Bonds34
Heavy Atoms189
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002673.33
LogP ≤ 525.86
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1030

Analyze N-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide?
The IUPAC name of N-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide (CID 173212974) is N-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide.
What is the SMILES notation for N-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide?
The canonical SMILES for N-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide is CCCNC(=O)Cc1c(C)n(C(=O)c2ccc(OC(F)(F)F)cc2)c2cc(F)c(OC)cc12.CCNC(=O)Cc1c(C)n(C(=O)c2ccc(OC(F)(F)F)cc2)c2cc(F)c(OC)cc12.CNC(=O)Cc1c(C)n(C(=O)c2ccc(OC(F)(F)F)cc2)c2cc(F)c(OC)cc12.COc1cc2c(CC(=O)NC(C)C)c(C)n(C(=O)c3ccc(OC(F)(F)F)cc3)c2cc1F.COc1cc2c(CC(=O)O)c(C)n(C(=O)c3ccc(OC(F)(F)F)cc3)c2cc1F.COc1cc2c(CC(N)=O)c(C)n(C(=O)c3ccc(OC(F)(F)F)cc3)c2cc1F.
What is the InChIKey of N-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide?
The InChIKey is DWNDHYRRIWYNFB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C23H22F4N2O4.C22H20F4N2O4.C21H18F4N2O4.C20H16F4N2O4.C20H15F4NO5/c1-12(2)28-21(30)10-16-13(3)29(19-11-18(24)20(32-4)9-17(16)19)22(31)14-5-7-15(8-6-14)33-23(25,26)27;1-4-9-28-21(30)11-16-13(2)29(19-12-18(24)20(32-3)10-17(16)19)22(31)14-5-7-15(8-6-14)33-23(25,26)27;1-4-27-20(29)10-15-12(2)28(18-11-17(23)19(31-3)9-16(15)18)21(30)13-5-7-14(8-6-13)32-22(24,25)26;1-11-14(9-19(28)26-2)15-8-18(30-3)16(22)10-17(15)27(11)20(29)12-4-6-13(7-5-12)31-21(23,24)25;1-10-13(8-18(25)27)14-7-17(29-2)15(21)9-16(14)26(10)19(28)11-3-5-12(6-4-11)30-20(22,23)24;1-10-13(8-18(26)27)14-7-17(29-2)15(21)9-16(14)25(10)19(28)11-3-5-12(6-4-11)30-20(22,23)24/h5-9,11-12H,10H2,1-4H3,(H,28,30);5-8,10,12H,4,9,11H2,1-3H3,(H,28,30);5-9,11H,4,10H2,1-3H3,(H,27,29);4-8,10H,9H2,1-3H3,(H,26,28);3-7,9H,8H2,1-2H3,(H2,25,27);3-7,9H,8H2,1-2H3,(H,26,27).
What are the key properties of N-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide?
N-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide has a molecular weight of 2673.33 g/mol, XLogP of 25.86, 34 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-methoxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide is sourced from PubChem (CID 173212974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).