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

C7H10F3NO — CID 163211464

IUPAC2-cyclopropyl-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(CC1CC1)NCC(F)(F)F
InChIInChI=1S/C7H10F3NO/c8-7(9,10)4-11-6(12)3-5-1-2-5/h5H,1-4H2,(H,11,12)
InChIKeySORVOEFDIFDRQA-UHFFFAOYSA-N
MW181.16 g/mol
LogP1.47
Rot. Bonds3

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

2-cyclopropyl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 163211464) has the molecular formula C7H10F3NO and a molecular weight of 181.16 g/mol. Its IUPAC name is 2-cyclopropyl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-cyclopropyl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID163211464
Molecular FormulaC7H10F3NO
Molecular Weight181.16 g/mol
Exact Mass181.07
IUPAC Name2-cyclopropyl-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(CC1CC1)NCC(F)(F)F
InChIInChI=1S/C7H10F3NO/c8-7(9,10)4-11-6(12)3-5-1-2-5/h5H,1-4H2,(H,11,12)
InChIKeySORVOEFDIFDRQA-UHFFFAOYSA-N
XLogP1.47
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.16
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-cyclopropyl-N-(2,2,2-trifluoroethyl)acetamide (CID 163211464) is 2-cyclopropyl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-cyclopropyl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-cyclopropyl-N-(2,2,2-trifluoroethyl)acetamide is O=C(CC1CC1)NCC(F)(F)F.
What is the InChIKey of 2-cyclopropyl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is SORVOEFDIFDRQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F3NO/c8-7(9,10)4-11-6(12)3-5-1-2-5/h5H,1-4H2,(H,11,12).
What are the key properties of 2-cyclopropyl-N-(2,2,2-trifluoroethyl)acetamide?
2-cyclopropyl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 181.16 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 163211464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).