N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide

C10H16F3NO3 — CID 94866670

IUPACN-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide
SMILESC[C@@H](NC(=O)COCC(F)(F)F)[C@@H]1CCCO1
InChIInChI=1S/C10H16F3NO3/c1-7(8-3-2-4-17-8)14-9(15)5-16-6-10(11,12)13/h7-8H,2-6H2,1H3,(H,14,15)/t7-,8+/m1/s1
InChIKeyURAAGWAACBJCQB-SFYZADRCSA-N
MW255.24 g/mol
LogP1.25
Rot. Bonds5

About N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide

N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide (PubChem CID 94866670) has the molecular formula C10H16F3NO3 and a molecular weight of 255.24 g/mol. Its IUPAC name is N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide.

Molecular Properties

Compound NameN-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide
PubChem CID94866670
Molecular FormulaC10H16F3NO3
Molecular Weight255.24 g/mol
Exact Mass255.11
IUPAC NameN-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide
SMILESC[C@@H](NC(=O)COCC(F)(F)F)[C@@H]1CCCO1
InChIInChI=1S/C10H16F3NO3/c1-7(8-3-2-4-17-8)14-9(15)5-16-6-10(11,12)13/h7-8H,2-6H2,1H3,(H,14,15)/t7-,8+/m1/s1
InChIKeyURAAGWAACBJCQB-SFYZADRCSA-N
XLogP1.25
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.24
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide?
The IUPAC name of N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide (CID 94866670) is N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide.
What is the SMILES notation for N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide?
The canonical SMILES for N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide is C[C@@H](NC(=O)COCC(F)(F)F)[C@@H]1CCCO1.
What is the InChIKey of N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide?
The InChIKey is URAAGWAACBJCQB-SFYZADRCSA-N. The full InChI is InChI=1S/C10H16F3NO3/c1-7(8-3-2-4-17-8)14-9(15)5-16-6-10(11,12)13/h7-8H,2-6H2,1H3,(H,14,15)/t7-,8+/m1/s1.
What are the key properties of N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide?
N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide has a molecular weight of 255.24 g/mol, XLogP of 1.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide is sourced from PubChem (CID 94866670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).