N-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide

C9H15F3N2O2 — CID 103209571

IUPACN-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide
SMILESCCN(C(=O)COCC(F)(F)F)C1CNC1
InChIInChI=1S/C9H15F3N2O2/c1-2-14(7-3-13-4-7)8(15)5-16-6-9(10,11)12/h7,13H,2-6H2,1H3
InChIKeyQYABDVZXMUIYGA-UHFFFAOYSA-N
MW240.22 g/mol
LogP0.39
Rot. Bonds5

About N-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide

N-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide (PubChem CID 103209571) has the molecular formula C9H15F3N2O2 and a molecular weight of 240.22 g/mol. Its IUPAC name is N-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide.

Molecular Properties

Compound NameN-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide
PubChem CID103209571
Molecular FormulaC9H15F3N2O2
Molecular Weight240.22 g/mol
Exact Mass240.11
IUPAC NameN-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide
SMILESCCN(C(=O)COCC(F)(F)F)C1CNC1
InChIInChI=1S/C9H15F3N2O2/c1-2-14(7-3-13-4-7)8(15)5-16-6-9(10,11)12/h7,13H,2-6H2,1H3
InChIKeyQYABDVZXMUIYGA-UHFFFAOYSA-N
XLogP0.39
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.22
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide?
The IUPAC name of N-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide (CID 103209571) is N-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide.
What is the SMILES notation for N-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide?
The canonical SMILES for N-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide is CCN(C(=O)COCC(F)(F)F)C1CNC1.
What is the InChIKey of N-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide?
The InChIKey is QYABDVZXMUIYGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F3N2O2/c1-2-14(7-3-13-4-7)8(15)5-16-6-9(10,11)12/h7,13H,2-6H2,1H3.
What are the key properties of N-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide?
N-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide has a molecular weight of 240.22 g/mol, XLogP of 0.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)acetamide is sourced from PubChem (CID 103209571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).