N,N-bis(2,2,2-trifluoroethyl)acetamide

C6H7F6NO — CID 54084492

IUPACN,N-bis(2,2,2-trifluoroethyl)acetamide
SMILESCC(=O)N(CC(F)(F)F)CC(F)(F)F
InChIInChI=1S/C6H7F6NO/c1-4(14)13(2-5(7,8)9)3-6(10,11)12/h2-3H2,1H3
InChIKeyCHEUHKADOFHAIZ-UHFFFAOYSA-N
MW223.12 g/mol
LogP1.96
Rot. Bonds2

About N,N-bis(2,2,2-trifluoroethyl)acetamide

N,N-bis(2,2,2-trifluoroethyl)acetamide (PubChem CID 54084492) has the molecular formula C6H7F6NO and a molecular weight of 223.12 g/mol. Its IUPAC name is N,N-bis(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound NameN,N-bis(2,2,2-trifluoroethyl)acetamide
PubChem CID54084492
Molecular FormulaC6H7F6NO
Molecular Weight223.12 g/mol
Exact Mass223.04
IUPAC NameN,N-bis(2,2,2-trifluoroethyl)acetamide
SMILESCC(=O)N(CC(F)(F)F)CC(F)(F)F
InChIInChI=1S/C6H7F6NO/c1-4(14)13(2-5(7,8)9)3-6(10,11)12/h2-3H2,1H3
InChIKeyCHEUHKADOFHAIZ-UHFFFAOYSA-N
XLogP1.96
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.12
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of N,N-bis(2,2,2-trifluoroethyl)acetamide (CID 54084492) is N,N-bis(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for N,N-bis(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for N,N-bis(2,2,2-trifluoroethyl)acetamide is CC(=O)N(CC(F)(F)F)CC(F)(F)F.
What is the InChIKey of N,N-bis(2,2,2-trifluoroethyl)acetamide?
The InChIKey is CHEUHKADOFHAIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7F6NO/c1-4(14)13(2-5(7,8)9)3-6(10,11)12/h2-3H2,1H3.
What are the key properties of N,N-bis(2,2,2-trifluoroethyl)acetamide?
N,N-bis(2,2,2-trifluoroethyl)acetamide has a molecular weight of 223.12 g/mol, XLogP of 1.96, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 54084492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).