2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide

C7H9F6NO — CID 64592645

IUPAC2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)N(CC(F)(F)F)C(=O)C(F)(F)F
InChIInChI=1S/C7H9F6NO/c1-4(2)14(3-6(8,9)10)5(15)7(11,12)13/h4H,3H2,1-2H3
InChIKeyBPZKEBCXBSZPEE-UHFFFAOYSA-N
MW237.14 g/mol
LogP2.35
Rot. Bonds2

About 2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide

2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 64592645) has the molecular formula C7H9F6NO and a molecular weight of 237.14 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID64592645
Molecular FormulaC7H9F6NO
Molecular Weight237.14 g/mol
Exact Mass237.06
IUPAC Name2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)N(CC(F)(F)F)C(=O)C(F)(F)F
InChIInChI=1S/C7H9F6NO/c1-4(2)14(3-6(8,9)10)5(15)7(11,12)13/h4H,3H2,1-2H3
InChIKeyBPZKEBCXBSZPEE-UHFFFAOYSA-N
XLogP2.35
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.14
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide
CID 60770828
(2S)-2-amino-3-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)butanamide
CID 61165092
2-methyl-3-oxo-3-[propan-2-yl(2,2,2-trifluoroethyl)amino]propanoic acid
CID 114897583
2-(methylamino)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide
CID 62636977
(2S)-2-amino-N-propan-2-yl-N-(2,2,2-trifluoroethyl)butanamide
CID 79024502
(2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)butanamide
CID 103929257
2-methyl-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)propanamide
CID 64592028
4-methyl-2-oxo-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pentanamide
CID 134570976
3-ethyl-1-propan-2-yl-1-(2,2,2-trifluoroethyl)urea
CID 115585947
2,2,2-trifluoro-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide
CID 63374882
(2S)-2-amino-N-propan-2-yl-N-(2,2,2-trifluoroethyl)hexanamide
CID 107144500
2-ethylsulfinyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
CID 75427200

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide (CID 64592645) is 2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide is CC(C)N(CC(F)(F)F)C(=O)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is BPZKEBCXBSZPEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F6NO/c1-4(2)14(3-6(8,9)10)5(15)7(11,12)13/h4H,3H2,1-2H3.
What are the key properties of 2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 237.14 g/mol, XLogP of 2.35, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 64592645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).