1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine

C10H18F3NO — CID 103216406

IUPAC1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine
SMILESCCNC(COCC(F)(F)F)C1CCC1
InChIInChI=1S/C10H18F3NO/c1-2-14-9(8-4-3-5-8)6-15-7-10(11,12)13/h8-9,14H,2-7H2,1H3
InChIKeyXSUQNAFEWMDXIQ-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.34
Rot. Bonds6

About 1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine

1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine (PubChem CID 103216406) has the molecular formula C10H18F3NO and a molecular weight of 225.25 g/mol. Its IUPAC name is 1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine.

Molecular Properties

Compound Name1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine
PubChem CID103216406
Molecular FormulaC10H18F3NO
Molecular Weight225.25 g/mol
Exact Mass225.13
IUPAC Name1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine
SMILESCCNC(COCC(F)(F)F)C1CCC1
InChIInChI=1S/C10H18F3NO/c1-2-14-9(8-4-3-5-8)6-15-7-10(11,12)13/h8-9,14H,2-7H2,1H3
InChIKeyXSUQNAFEWMDXIQ-UHFFFAOYSA-N
XLogP2.34
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine?
The IUPAC name of 1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine (CID 103216406) is 1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine.
What is the SMILES notation for 1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine?
The canonical SMILES for 1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine is CCNC(COCC(F)(F)F)C1CCC1.
What is the InChIKey of 1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine?
The InChIKey is XSUQNAFEWMDXIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO/c1-2-14-9(8-4-3-5-8)6-15-7-10(11,12)13/h8-9,14H,2-7H2,1H3.
What are the key properties of 1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine?
1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine has a molecular weight of 225.25 g/mol, XLogP of 2.34, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine is sourced from PubChem (CID 103216406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).