2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide

C24H30F3N3O3 — CID 24566061

IUPAC2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide
SMILESCCN(CC(=O)Nc1ccccc1C(F)(F)F)CC(=O)NC(c1ccc(OC)cc1)C(C)C
InChIInChI=1S/C24H30F3N3O3/c1-5-30(14-21(31)28-20-9-7-6-8-19(20)24(25,26)27)15-22(32)29-23(16(2)3)17-10-12-18(33-4)13-11-17/h6-13,16,23H,5,14-15H2,1-4H3,(H,28,31)(H,29,32)
InChIKeySMIGFSMDOVJNNY-UHFFFAOYSA-N
MW465.52 g/mol
LogP4.49
Rot. Bonds10

About 2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide

2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide (PubChem CID 24566061) has the molecular formula C24H30F3N3O3 and a molecular weight of 465.52 g/mol. Its IUPAC name is 2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide
PubChem CID24566061
Molecular FormulaC24H30F3N3O3
Molecular Weight465.52 g/mol
Exact Mass465.22
IUPAC Name2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide
SMILESCCN(CC(=O)Nc1ccccc1C(F)(F)F)CC(=O)NC(c1ccc(OC)cc1)C(C)C
InChIInChI=1S/C24H30F3N3O3/c1-5-30(14-21(31)28-20-9-7-6-8-19(20)24(25,26)27)15-22(32)29-23(16(2)3)17-10-12-18(33-4)13-11-17/h6-13,16,23H,5,14-15H2,1-4H3,(H,28,31)(H,29,32)
InChIKeySMIGFSMDOVJNNY-UHFFFAOYSA-N
XLogP4.49
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.52
LogP ≤ 54.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[ethyl-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]amino]-N-(3-methoxyphenyl)acetamide
CID 9030983
2-[ethyl-[(4-propan-2-ylphenyl)methyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 26514549
N-(4-acetamidophenyl)-2-[ethyl-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]amino]acetamide
CID 27199750
2-[[2-(2,5-diethoxyanilino)-2-oxoethyl]-ethylamino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 24566060
N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 55543815
2-[(4-methoxyphenyl)methyl-methylamino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 4883947
2-[[2-(tert-butylcarbamoylamino)-2-oxoethyl]-ethylamino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 9030856
2-[ethyl-[2-oxo-2-(propylcarbamoylamino)ethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 40710223
2-(4-methoxyphenyl)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 668862
2-[ethyl-[(7-methoxy-2-oxochromen-4-yl)methyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 27219969
2-[[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]carbamoyl-methylamino]-N-naphthalen-1-ylacetamide
CID 41253031
2-[ethyl-(2-hydroxy-3-propan-2-yloxypropyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 78827764

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide (CID 24566061) is 2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide is CCN(CC(=O)Nc1ccccc1C(F)(F)F)CC(=O)NC(c1ccc(OC)cc1)C(C)C.
What is the InChIKey of 2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide?
The InChIKey is SMIGFSMDOVJNNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30F3N3O3/c1-5-30(14-21(31)28-20-9-7-6-8-19(20)24(25,26)27)15-22(32)29-23(16(2)3)17-10-12-18(33-4)13-11-17/h6-13,16,23H,5,14-15H2,1-4H3,(H,28,31)(H,29,32).
What are the key properties of 2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide?
2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide has a molecular weight of 465.52 g/mol, XLogP of 4.49, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 24566061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).