2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide

C7H10F3NO2 — CID 82736677

IUPAC2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide
SMILESCC1OCCC1NC(=O)C(F)(F)F
InChIInChI=1S/C7H10F3NO2/c1-4-5(2-3-13-4)11-6(12)7(8,9)10/h4-5H,2-3H2,1H3,(H,11,12)
InChIKeyWWVCZKVWTYHMPP-UHFFFAOYSA-N
MW197.16 g/mol
LogP0.84
Rot. Bonds1

About 2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide

2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide (PubChem CID 82736677) has the molecular formula C7H10F3NO2 and a molecular weight of 197.16 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide
PubChem CID82736677
Molecular FormulaC7H10F3NO2
Molecular Weight197.16 g/mol
Exact Mass197.07
IUPAC Name2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide
SMILESCC1OCCC1NC(=O)C(F)(F)F
InChIInChI=1S/C7H10F3NO2/c1-4-5(2-3-13-4)11-6(12)7(8,9)10/h4-5H,2-3H2,1H3,(H,11,12)
InChIKeyWWVCZKVWTYHMPP-UHFFFAOYSA-N
XLogP0.84
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.16
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide?
The IUPAC name of 2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide (CID 82736677) is 2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide is CC1OCCC1NC(=O)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide?
The InChIKey is WWVCZKVWTYHMPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F3NO2/c1-4-5(2-3-13-4)11-6(12)7(8,9)10/h4-5H,2-3H2,1H3,(H,11,12).
What are the key properties of 2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide?
2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide has a molecular weight of 197.16 g/mol, XLogP of 0.84, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-(2-methyloxolan-3-yl)acetamide is sourced from PubChem (CID 82736677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).