2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide

C10H18F3N3O2 — CID 54871521

IUPAC2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide
SMILESCCCC(N)C(=O)N(C)CC(=O)NCC(F)(F)F
InChIInChI=1S/C10H18F3N3O2/c1-3-4-7(14)9(18)16(2)5-8(17)15-6-10(11,12)13/h7H,3-6,14H2,1-2H3,(H,15,17)
InChIKeyILZYNTQTWJEWKW-UHFFFAOYSA-N
MW269.27 g/mol
LogP0.25
Rot. Bonds6

About 2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide

2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide (PubChem CID 54871521) has the molecular formula C10H18F3N3O2 and a molecular weight of 269.27 g/mol. Its IUPAC name is 2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide
PubChem CID54871521
Molecular FormulaC10H18F3N3O2
Molecular Weight269.27 g/mol
Exact Mass269.14
IUPAC Name2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide
SMILESCCCC(N)C(=O)N(C)CC(=O)NCC(F)(F)F
InChIInChI=1S/C10H18F3N3O2/c1-3-4-7(14)9(18)16(2)5-8(17)15-6-10(11,12)13/h7H,3-6,14H2,1-2H3,(H,15,17)
InChIKeyILZYNTQTWJEWKW-UHFFFAOYSA-N
XLogP0.25
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.27
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide?
The IUPAC name of 2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide (CID 54871521) is 2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide.
What is the SMILES notation for 2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide?
The canonical SMILES for 2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide is CCCC(N)C(=O)N(C)CC(=O)NCC(F)(F)F.
What is the InChIKey of 2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide?
The InChIKey is ILZYNTQTWJEWKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3N3O2/c1-3-4-7(14)9(18)16(2)5-8(17)15-6-10(11,12)13/h7H,3-6,14H2,1-2H3,(H,15,17).
What are the key properties of 2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide?
2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide has a molecular weight of 269.27 g/mol, XLogP of 0.25, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide is sourced from PubChem (CID 54871521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).