N-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide

C8H15F3N2O — CID 28595908

IUPACN-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCC(C)(C)NC(=O)CNCC(F)(F)F
InChIInChI=1S/C8H15F3N2O/c1-7(2,3)13-6(14)4-12-5-8(9,10)11/h12H,4-5H2,1-3H3,(H,13,14)
InChIKeyHDIPIHQLFKJSFE-UHFFFAOYSA-N
MW212.21 g/mol
LogP1.05
Rot. Bonds3

About N-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide

N-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 28595908) has the molecular formula C8H15F3N2O and a molecular weight of 212.21 g/mol. Its IUPAC name is N-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID28595908
Molecular FormulaC8H15F3N2O
Molecular Weight212.21 g/mol
Exact Mass212.11
IUPAC NameN-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCC(C)(C)NC(=O)CNCC(F)(F)F
InChIInChI=1S/C8H15F3N2O/c1-7(2,3)13-6(14)4-12-5-8(9,10)11/h12H,4-5H2,1-3H3,(H,13,14)
InChIKeyHDIPIHQLFKJSFE-UHFFFAOYSA-N
XLogP1.05
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.21
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Tert-butylamino)acetamide
CID 15839440
N1-isobutyl-N2-(2,2,2-trifluoroethyl)oxalamide
CID 45585739
N-(tert-butyl)-2-(methylamino)acetamide
CID 4962512
1,2-Diaminoethane, N-trifluoroacetyl-2,2-dimethyl-
CID 546891
N-tert-butyl-2-(ethylamino)acetamide hydrochloride
CID 16243470
2-amino-N-ethyl-3,3,3-trifluoro-2-methylpropanamide
CID 79789707
3,3-Difluoro-2-methyl-2-(methylamino)propanamide
CID 165989600
N-tert-butyl-2-[butyl(2,2,2-trifluoroethyl)amino]acetamide
CID 56788582
N-[3,3,3-trifluoro-2-methyl-2-(propanoylamino)propyl]propanamide
CID 119052926
2-(ethylamino)-3,3,3-trifluoro-N-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-2-(trifluoromethyl)propanamide
CID 12736424
2,2,2-trifluoro-N-(3-methylazetidin-3-yl)acetamide
CID 20087920
2-(methylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 24696392

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of N-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide (CID 28595908) is N-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for N-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for N-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide is CC(C)(C)NC(=O)CNCC(F)(F)F.
What is the InChIKey of N-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is HDIPIHQLFKJSFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F3N2O/c1-7(2,3)13-6(14)4-12-5-8(9,10)11/h12H,4-5H2,1-3H3,(H,13,14).
What are the key properties of N-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide?
N-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 212.21 g/mol, XLogP of 1.05, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 28595908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).