2-cyclobutyl-2-(difluoromethoxy)ethanamine

C7H13F2NO — CID 84717024

IUPAC2-cyclobutyl-2-(difluoromethoxy)ethanamine
SMILESNCC(OC(F)F)C1CCC1
InChIInChI=1S/C7H13F2NO/c8-7(9)11-6(4-10)5-2-1-3-5/h5-7H,1-4,10H2
InChIKeyYFPJDWNMDUUZRU-UHFFFAOYSA-N
MW165.18 g/mol
LogP1.35
Rot. Bonds4

About 2-cyclobutyl-2-(difluoromethoxy)ethanamine

2-cyclobutyl-2-(difluoromethoxy)ethanamine (PubChem CID 84717024) has the molecular formula C7H13F2NO and a molecular weight of 165.18 g/mol. Its IUPAC name is 2-cyclobutyl-2-(difluoromethoxy)ethanamine.

Molecular Properties

Compound Name2-cyclobutyl-2-(difluoromethoxy)ethanamine
PubChem CID84717024
Molecular FormulaC7H13F2NO
Molecular Weight165.18 g/mol
Exact Mass165.10
IUPAC Name2-cyclobutyl-2-(difluoromethoxy)ethanamine
SMILESNCC(OC(F)F)C1CCC1
InChIInChI=1S/C7H13F2NO/c8-7(9)11-6(4-10)5-2-1-3-5/h5-7H,1-4,10H2
InChIKeyYFPJDWNMDUUZRU-UHFFFAOYSA-N
XLogP1.35
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.18
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-2-(difluoromethoxy)ethanamine?
The IUPAC name of 2-cyclobutyl-2-(difluoromethoxy)ethanamine (CID 84717024) is 2-cyclobutyl-2-(difluoromethoxy)ethanamine.
What is the SMILES notation for 2-cyclobutyl-2-(difluoromethoxy)ethanamine?
The canonical SMILES for 2-cyclobutyl-2-(difluoromethoxy)ethanamine is NCC(OC(F)F)C1CCC1.
What is the InChIKey of 2-cyclobutyl-2-(difluoromethoxy)ethanamine?
The InChIKey is YFPJDWNMDUUZRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F2NO/c8-7(9)11-6(4-10)5-2-1-3-5/h5-7H,1-4,10H2.
What are the key properties of 2-cyclobutyl-2-(difluoromethoxy)ethanamine?
2-cyclobutyl-2-(difluoromethoxy)ethanamine has a molecular weight of 165.18 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-2-(difluoromethoxy)ethanamine is sourced from PubChem (CID 84717024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).