2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine

C8H14F3NO — CID 103273030

IUPAC2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine
SMILESNCCC1(OCC(F)(F)F)CCC1
InChIInChI=1S/C8H14F3NO/c9-8(10,11)6-13-7(4-5-12)2-1-3-7/h1-6,12H2
InChIKeyGNCWBRINQGZOJO-UHFFFAOYSA-N
MW197.20 g/mol
LogP1.84
Rot. Bonds4

About 2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine

2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine (PubChem CID 103273030) has the molecular formula C8H14F3NO and a molecular weight of 197.20 g/mol. Its IUPAC name is 2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine.

Molecular Properties

Compound Name2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine
PubChem CID103273030
Molecular FormulaC8H14F3NO
Molecular Weight197.20 g/mol
Exact Mass197.10
IUPAC Name2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine
SMILESNCCC1(OCC(F)(F)F)CCC1
InChIInChI=1S/C8H14F3NO/c9-8(10,11)6-13-7(4-5-12)2-1-3-7/h1-6,12H2
InChIKeyGNCWBRINQGZOJO-UHFFFAOYSA-N
XLogP1.84
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine?
The IUPAC name of 2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine (CID 103273030) is 2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine.
What is the SMILES notation for 2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine?
The canonical SMILES for 2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine is NCCC1(OCC(F)(F)F)CCC1.
What is the InChIKey of 2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine?
The InChIKey is GNCWBRINQGZOJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO/c9-8(10,11)6-13-7(4-5-12)2-1-3-7/h1-6,12H2.
What are the key properties of 2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine?
2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine has a molecular weight of 197.20 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine is sourced from PubChem (CID 103273030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).