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

C8H13F3N2O2 — CID 103209567

IUPACN-(azetidin-3-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)acetamide
SMILESCN(C(=O)COCC(F)(F)F)C1CNC1
InChIInChI=1S/C8H13F3N2O2/c1-13(6-2-12-3-6)7(14)4-15-5-8(9,10)11/h6,12H,2-5H2,1H3
InChIKeyKKVPBSPCUIEIIT-UHFFFAOYSA-N
MW226.20 g/mol
LogP-0.00
Rot. Bonds4

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

N-(azetidin-3-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)acetamide (PubChem CID 103209567) has the molecular formula C8H13F3N2O2 and a molecular weight of 226.20 g/mol. Its IUPAC name is N-(azetidin-3-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)acetamide.

Molecular Properties

Compound NameN-(azetidin-3-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)acetamide
PubChem CID103209567
Molecular FormulaC8H13F3N2O2
Molecular Weight226.20 g/mol
Exact Mass226.09
IUPAC NameN-(azetidin-3-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)acetamide
SMILESCN(C(=O)COCC(F)(F)F)C1CNC1
InChIInChI=1S/C8H13F3N2O2/c1-13(6-2-12-3-6)7(14)4-15-5-8(9,10)11/h6,12H,2-5H2,1H3
InChIKeyKKVPBSPCUIEIIT-UHFFFAOYSA-N
XLogP-0.00
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.20
LogP ≤ 5-0.00
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-methyl-2-(2,2,2-trifluoroethoxy)acetamide?
The IUPAC name of N-(azetidin-3-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)acetamide (CID 103209567) is N-(azetidin-3-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)acetamide.
What is the SMILES notation for N-(azetidin-3-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)acetamide?
The canonical SMILES for N-(azetidin-3-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)acetamide is CN(C(=O)COCC(F)(F)F)C1CNC1.
What is the InChIKey of N-(azetidin-3-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)acetamide?
The InChIKey is KKVPBSPCUIEIIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F3N2O2/c1-13(6-2-12-3-6)7(14)4-15-5-8(9,10)11/h6,12H,2-5H2,1H3.
What are the key properties of N-(azetidin-3-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)acetamide?
N-(azetidin-3-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)acetamide has a molecular weight of 226.20 g/mol, XLogP of -0.00, 4 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-methyl-2-(2,2,2-trifluoroethoxy)acetamide is sourced from PubChem (CID 103209567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).