2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide

C11H20F3N3O2 — CID 54871700

IUPAC2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide
SMILESCC(C)CC(N)C(=O)N(C)CC(=O)NCC(F)(F)F
InChIInChI=1S/C11H20F3N3O2/c1-7(2)4-8(15)10(19)17(3)5-9(18)16-6-11(12,13)14/h7-8H,4-6,15H2,1-3H3,(H,16,18)
InChIKeyTZOSHJSFNQTMFD-UHFFFAOYSA-N
MW283.29 g/mol
LogP0.50
Rot. Bonds6

About 2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide

2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide (PubChem CID 54871700) has the molecular formula C11H20F3N3O2 and a molecular weight of 283.29 g/mol. Its IUPAC name is 2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide.

Molecular Properties

Compound Name2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide
PubChem CID54871700
Molecular FormulaC11H20F3N3O2
Molecular Weight283.29 g/mol
Exact Mass283.15
IUPAC Name2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide
SMILESCC(C)CC(N)C(=O)N(C)CC(=O)NCC(F)(F)F
InChIInChI=1S/C11H20F3N3O2/c1-7(2)4-8(15)10(19)17(3)5-9(18)16-6-11(12,13)14/h7-8H,4-6,15H2,1-3H3,(H,16,18)
InChIKeyTZOSHJSFNQTMFD-UHFFFAOYSA-N
XLogP0.50
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 11623159
CID 11623159
CID 23648298
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CID 11557656
CID 11557656
CID 131032
CID 131032
CID 9970317
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CID 18458068
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CID 3634567
CID 3634567
CID 16091636
CID 16091636

Frequently Asked Questions

What is the IUPAC name of 2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide?
The IUPAC name of 2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide (CID 54871700) is 2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide.
What is the SMILES notation for 2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide?
The canonical SMILES for 2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide is CC(C)CC(N)C(=O)N(C)CC(=O)NCC(F)(F)F.
What is the InChIKey of 2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide?
The InChIKey is TZOSHJSFNQTMFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3N3O2/c1-7(2)4-8(15)10(19)17(3)5-9(18)16-6-11(12,13)14/h7-8H,4-6,15H2,1-3H3,(H,16,18).
What are the key properties of 2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide?
2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide has a molecular weight of 283.29 g/mol, XLogP of 0.50, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,4-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pentanamide is sourced from PubChem (CID 54871700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).