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

C123H101F24N11O25 — CID 173212825

IUPACN-ethyl-2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-hydroxy-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(O)cc12.CCNC(=O)Cc1c(C)n(C(=O)c2ccc(OC(F)(F)F)cc2)c2cc(F)c(O)cc12.CNC(=O)Cc1c(C)n(C(=O)c2ccc(OC(F)(F)F)cc2)c2cc(F)c(O)cc12.Cc1c(CC(=O)NC(C)C)c2cc(O)c(F)cc2n1C(=O)c1ccc(OC(F)(F)F)cc1.Cc1c(CC(=O)O)c2cc(O)c(F)cc2n1C(=O)c1ccc(OC(F)(F)F)cc1.Cc1c(CC(N)=O)c2cc(O)c(F)cc2n1C(=O)c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/2C22H20F4N2O4.C21H18F4N2O4.C20H16F4N2O4.C19H14F4N2O4.C19H13F4NO5/c1-11(2)27-20(30)9-15-12(3)28(18-10-17(23)19(29)8-16(15)18)21(31)13-4-6-14(7-5-13)32-22(24,25)26;1-3-8-27-20(30)10-15-12(2)28(18-11-17(23)19(29)9-16(15)18)21(31)13-4-6-14(7-5-13)32-22(24,25)26;1-3-26-19(29)9-14-11(2)27(17-10-16(22)18(28)8-15(14)17)20(30)12-4-6-13(7-5-12)31-21(23,24)25;1-10-13(8-18(28)25-2)14-7-17(27)15(21)9-16(14)26(10)19(29)11-3-5-12(6-4-11)30-20(22,23)24;1-9-12(7-17(24)27)13-6-16(26)14(20)8-15(13)25(9)18(28)10-2-4-11(5-3-10)29-19(21,22)23;1-9-12(7-17(26)27)13-6-16(25)14(20)8-15(13)24(9)18(28)10-2-4-11(5-3-10)29-19(21,22)23/h4-8,10-11,29H,9H2,1-3H3,(H,27,30);4-7,9,11,29H,3,8,10H2,1-2H3,(H,27,30);4-8,10,28H,3,9H2,1-2H3,(H,26,29);3-7,9,27H,8H2,1-2H3,(H,25,28);2-6,8,26H,7H2,1H3,(H2,24,27);2-6,8,25H,7H2,1H3,(H,26,27)
InChIKeyYRYHMTJGHCRNLP-UHFFFAOYSA-N
MW2589.16 g/mol
LogP24.05
Rot. Bonds28

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

N-ethyl-2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide (PubChem CID 173212825) has the molecular formula C123H101F24N11O25 and a molecular weight of 2589.16 g/mol. Its IUPAC name is N-ethyl-2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide.

Molecular Properties

Compound NameN-ethyl-2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide
PubChem CID173212825
Molecular FormulaC123H101F24N11O25
Molecular Weight2589.16 g/mol
Exact Mass2587.66
IUPAC NameN-ethyl-2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-hydroxy-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(O)cc12.CCNC(=O)Cc1c(C)n(C(=O)c2ccc(OC(F)(F)F)cc2)c2cc(F)c(O)cc12.CNC(=O)Cc1c(C)n(C(=O)c2ccc(OC(F)(F)F)cc2)c2cc(F)c(O)cc12.Cc1c(CC(=O)NC(C)C)c2cc(O)c(F)cc2n1C(=O)c1ccc(OC(F)(F)F)cc1.Cc1c(CC(=O)O)c2cc(O)c(F)cc2n1C(=O)c1ccc(OC(F)(F)F)cc1.Cc1c(CC(N)=O)c2cc(O)c(F)cc2n1C(=O)c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/2C22H20F4N2O4.C21H18F4N2O4.C20H16F4N2O4.C19H14F4N2O4.C19H13F4NO5/c1-11(2)27-20(30)9-15-12(3)28(18-10-17(23)19(29)8-16(15)18)21(31)13-4-6-14(7-5-13)32-22(24,25)26;1-3-8-27-20(30)10-15-12(2)28(18-11-17(23)19(29)9-16(15)18)21(31)13-4-6-14(7-5-13)32-22(24,25)26;1-3-26-19(29)9-14-11(2)27(17-10-16(22)18(28)8-15(14)17)20(30)12-4-6-13(7-5-12)31-21(23,24)25;1-10-13(8-18(28)25-2)14-7-17(27)15(21)9-16(14)26(10)19(29)11-3-5-12(6-4-11)30-20(22,23)24;1-9-12(7-17(24)27)13-6-16(26)14(20)8-15(13)25(9)18(28)10-2-4-11(5-3-10)29-19(21,22)23;1-9-12(7-17(26)27)13-6-16(25)14(20)8-15(13)24(9)18(28)10-2-4-11(5-3-10)29-19(21,22)23/h4-8,10-11,29H,9H2,1-3H3,(H,27,30);4-7,9,11,29H,3,8,10H2,1-2H3,(H,27,30);4-8,10,28H,3,9H2,1-2H3,(H,26,29);3-7,9,27H,8H2,1-2H3,(H,25,28);2-6,8,26H,7H2,1H3,(H2,24,27);2-6,8,25H,7H2,1H3,(H,26,27)
InChIKeyYRYHMTJGHCRNLP-UHFFFAOYSA-N
XLogP24.05
TPSA505.55 Ų
H-Bond Donors12
H-Bond Acceptors30
Rotatable Bonds28
Heavy Atoms183
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002589.16
LogP ≤ 524.05
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1030

Analyze N-ethyl-2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-hydroxy-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-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide?
The IUPAC name of N-ethyl-2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide (CID 173212825) is N-ethyl-2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide.
What is the SMILES notation for N-ethyl-2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide?
The canonical SMILES for N-ethyl-2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-hydroxy-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(O)cc12.CCNC(=O)Cc1c(C)n(C(=O)c2ccc(OC(F)(F)F)cc2)c2cc(F)c(O)cc12.CNC(=O)Cc1c(C)n(C(=O)c2ccc(OC(F)(F)F)cc2)c2cc(F)c(O)cc12.Cc1c(CC(=O)NC(C)C)c2cc(O)c(F)cc2n1C(=O)c1ccc(OC(F)(F)F)cc1.Cc1c(CC(=O)O)c2cc(O)c(F)cc2n1C(=O)c1ccc(OC(F)(F)F)cc1.Cc1c(CC(N)=O)c2cc(O)c(F)cc2n1C(=O)c1ccc(OC(F)(F)F)cc1.
What is the InChIKey of N-ethyl-2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide?
The InChIKey is YRYHMTJGHCRNLP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C22H20F4N2O4.C21H18F4N2O4.C20H16F4N2O4.C19H14F4N2O4.C19H13F4NO5/c1-11(2)27-20(30)9-15-12(3)28(18-10-17(23)19(29)8-16(15)18)21(31)13-4-6-14(7-5-13)32-22(24,25)26;1-3-8-27-20(30)10-15-12(2)28(18-11-17(23)19(29)9-16(15)18)21(31)13-4-6-14(7-5-13)32-22(24,25)26;1-3-26-19(29)9-14-11(2)27(17-10-16(22)18(28)8-15(14)17)20(30)12-4-6-13(7-5-12)31-21(23,24)25;1-10-13(8-18(28)25-2)14-7-17(27)15(21)9-16(14)26(10)19(29)11-3-5-12(6-4-11)30-20(22,23)24;1-9-12(7-17(24)27)13-6-16(26)14(20)8-15(13)25(9)18(28)10-2-4-11(5-3-10)29-19(21,22)23;1-9-12(7-17(26)27)13-6-16(25)14(20)8-15(13)24(9)18(28)10-2-4-11(5-3-10)29-19(21,22)23/h4-8,10-11,29H,9H2,1-3H3,(H,27,30);4-7,9,11,29H,3,8,10H2,1-2H3,(H,27,30);4-8,10,28H,3,9H2,1-2H3,(H,26,29);3-7,9,27H,8H2,1-2H3,(H,25,28);2-6,8,26H,7H2,1H3,(H2,24,27);2-6,8,25H,7H2,1H3,(H,26,27).
What are the key properties of N-ethyl-2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide?
N-ethyl-2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide has a molecular weight of 2589.16 g/mol, XLogP of 24.05, 28 rotatable bonds, 12 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]acetic acid;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-methylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propan-2-ylacetamide;2-[6-fluoro-5-hydroxy-2-methyl-1-[4-(trifluoromethoxy)benzoyl]indol-3-yl]-N-propylacetamide is sourced from PubChem (CID 173212825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).