2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide

C47H39Cl5F6N4O4 — CID 87659849

About 2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide

2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide (PubChem CID 87659849) has the molecular formula C47H39Cl5F6N4O4 and a molecular weight of 1015.11 g/mol. Its IUPAC name is 2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide.

Molecular Properties

• Compound Name: 2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide
• PubChem CID: 87659849
• Molecular Formula: C47H39Cl5F6N4O4
• Molecular Weight: 1015.11 g/mol
• Exact Mass: 1012.13
• IUPAC Name: 2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide
• SMILES: Cc1ccc2c(c1)c(C(=O)C(=O)NC1CCCC1)c(C(F)(F)F)n2Cc1ccc(Cl)cc1Cl.O=C(NC1CCCC1)C(=O)c1c(C(F)(F)F)n(Cc2ccc(Cl)cc2Cl)c2ccc(Cl)cc12
• InChI: InChI=1S/C24H21Cl2F3N2O2.C23H18Cl3F3N2O2/c1-13-6-9-19-17(10-13)20(21(32)23(33)30-16-4-2-3-5-16)22(24(27,28)29)31(19)12-14-7-8-15(25)11-18(14)26;24-13-7-8-18-16(9-13)19(20(32)22(33)30-15-3-1-2-4-15)21(23(27,28)29)31(18)11-12-5-6-14(25)10-17(12)26/h6-11,16H,2-5,12H2,1H3,(H,30,33);5-10,15H,1-4,11H2,(H,30,33)
• InChIKey: FYJDPJGNOTZYLI-UHFFFAOYSA-N
• XLogP: 13.48
• TPSA: 102.20 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 10
• Heavy Atoms: 66
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1015.11
LogP ≤ 5	13.48
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide?

The IUPAC name of 2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide (CID 87659849) is 2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide.

What is the SMILES notation for 2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide?

The canonical SMILES for 2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide is Cc1ccc2c(c1)c(C(=O)C(=O)NC1CCCC1)c(C(F)(F)F)n2Cc1ccc(Cl)cc1Cl.O=C(NC1CCCC1)C(=O)c1c(C(F)(F)F)n(Cc2ccc(Cl)cc2Cl)c2ccc(Cl)cc12.

What is the InChIKey of 2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide?

The InChIKey is FYJDPJGNOTZYLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21Cl2F3N2O2.C23H18Cl3F3N2O2/c1-13-6-9-19-17(10-13)20(21(32)23(33)30-16-4-2-3-5-16)22(24(27,28)29)31(19)12-14-7-8-15(25)11-18(14)26;24-13-7-8-18-16(9-13)19(20(32)22(33)30-15-3-1-2-4-15)21(23(27,28)29)31(18)11-12-5-6-14(25)10-17(12)26/h6-11,16H,2-5,12H2,1H3,(H,30,33);5-10,15H,1-4,11H2,(H,30,33).

What are the key properties of 2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide?

2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide has a molecular weight of 1015.11 g/mol, XLogP of 13.48, 10 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide is sourced from PubChem (CID 87659849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).