2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)acetamide

C8H15F3N2O — CID 60641181

IUPAC2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)(C)NCC(=O)NCC(F)(F)F
InChIInChI=1S/C8H15F3N2O/c1-7(2,3)13-4-6(14)12-5-8(9,10)11/h13H,4-5H2,1-3H3,(H,12,14)
InChIKeyAZHALATZBPLXHY-UHFFFAOYSA-N
MW212.21 g/mol
LogP1.05
Rot. Bonds3

About 2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)acetamide

2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 60641181) has the molecular formula C8H15F3N2O and a molecular weight of 212.21 g/mol. Its IUPAC name is 2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID60641181
Molecular FormulaC8H15F3N2O
Molecular Weight212.21 g/mol
Exact Mass212.11
IUPAC Name2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)(C)NCC(=O)NCC(F)(F)F
InChIInChI=1S/C8H15F3N2O/c1-7(2,3)13-4-6(14)12-5-8(9,10)11/h13H,4-5H2,1-3H3,(H,12,14)
InChIKeyAZHALATZBPLXHY-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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Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)acetamide (CID 60641181) is 2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)acetamide is CC(C)(C)NCC(=O)NCC(F)(F)F.
What is the InChIKey of 2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is AZHALATZBPLXHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F3N2O/c1-7(2,3)13-4-6(14)12-5-8(9,10)11/h13H,4-5H2,1-3H3,(H,12,14).
What are the key properties of 2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)acetamide?
2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)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 2-(tert-butylamino)-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 60641181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).