N-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide

C7H8F3NO3 — CID 162768562

IUPACN-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide
SMILESO=C(CO)N(C(=O)C(F)(F)F)C1CC1
InChIInChI=1S/C7H8F3NO3/c8-7(9,10)6(14)11(4-1-2-4)5(13)3-12/h4,12H,1-3H2
InChIKeyMCTBBRDTXZRQII-UHFFFAOYSA-N
MW211.14 g/mol
LogP0.06
Rot. Bonds2

About N-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide

N-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide (PubChem CID 162768562) has the molecular formula C7H8F3NO3 and a molecular weight of 211.14 g/mol. Its IUPAC name is N-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide
PubChem CID162768562
Molecular FormulaC7H8F3NO3
Molecular Weight211.14 g/mol
Exact Mass211.05
IUPAC NameN-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide
SMILESO=C(CO)N(C(=O)C(F)(F)F)C1CC1
InChIInChI=1S/C7H8F3NO3/c8-7(9,10)6(14)11(4-1-2-4)5(13)3-12/h4,12H,1-3H2
InChIKeyMCTBBRDTXZRQII-UHFFFAOYSA-N
XLogP0.06
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.14
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide?
The IUPAC name of N-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide (CID 162768562) is N-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide.
What is the SMILES notation for N-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide?
The canonical SMILES for N-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide is O=C(CO)N(C(=O)C(F)(F)F)C1CC1.
What is the InChIKey of N-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide?
The InChIKey is MCTBBRDTXZRQII-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F3NO3/c8-7(9,10)6(14)11(4-1-2-4)5(13)3-12/h4,12H,1-3H2.
What are the key properties of N-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide?
N-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide has a molecular weight of 211.14 g/mol, XLogP of 0.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide is sourced from PubChem (CID 162768562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).