2,2,2-trifluoro-N-methyl-N-propan-2-ylacetamide

C6H10F3NO — CID 64592054

IUPAC2,2,2-trifluoro-N-methyl-N-propan-2-ylacetamide
SMILESCC(C)N(C)C(=O)C(F)(F)F
InChIInChI=1S/C6H10F3NO/c1-4(2)10(3)5(11)6(7,8)9/h4H,1-3H3
InChIKeyRJGMNKYZPDMFOL-UHFFFAOYSA-N
MW169.15 g/mol
LogP1.42
Rot. Bonds1

About 2,2,2-trifluoro-N-methyl-N-propan-2-ylacetamide

2,2,2-trifluoro-N-methyl-N-propan-2-ylacetamide (PubChem CID 64592054) has the molecular formula C6H10F3NO and a molecular weight of 169.15 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-methyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-methyl-N-propan-2-ylacetamide
PubChem CID64592054
Molecular FormulaC6H10F3NO
Molecular Weight169.15 g/mol
Exact Mass169.07
IUPAC Name2,2,2-trifluoro-N-methyl-N-propan-2-ylacetamide
SMILESCC(C)N(C)C(=O)C(F)(F)F
InChIInChI=1S/C6H10F3NO/c1-4(2)10(3)5(11)6(7,8)9/h4H,1-3H3
InChIKeyRJGMNKYZPDMFOL-UHFFFAOYSA-N
XLogP1.42
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.15
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-methyl-N-propan-2-ylacetamide?
The IUPAC name of 2,2,2-trifluoro-N-methyl-N-propan-2-ylacetamide (CID 64592054) is 2,2,2-trifluoro-N-methyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-methyl-N-propan-2-ylacetamide?
The canonical SMILES for 2,2,2-trifluoro-N-methyl-N-propan-2-ylacetamide is CC(C)N(C)C(=O)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-methyl-N-propan-2-ylacetamide?
The InChIKey is RJGMNKYZPDMFOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F3NO/c1-4(2)10(3)5(11)6(7,8)9/h4H,1-3H3.
What are the key properties of 2,2,2-trifluoro-N-methyl-N-propan-2-ylacetamide?
2,2,2-trifluoro-N-methyl-N-propan-2-ylacetamide has a molecular weight of 169.15 g/mol, XLogP of 1.42, 1 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-methyl-N-propan-2-ylacetamide is sourced from PubChem (CID 64592054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).