2-(2,3-difluorophenoxy)ethanamine

C8H9F2NO — CID 63036211

IUPAC2-(2,3-difluorophenoxy)ethanamine
SMILESNCCOc1cccc(F)c1F
InChIInChI=1S/C8H9F2NO/c9-6-2-1-3-7(8(6)10)12-5-4-11/h1-3H,4-5,11H2
InChIKeyJACRJZWMGNYVBO-UHFFFAOYSA-N
MW173.16 g/mol
LogP1.30
Rot. Bonds3

About 2-(2,3-difluorophenoxy)ethanamine

2-(2,3-difluorophenoxy)ethanamine (PubChem CID 63036211) has the molecular formula C8H9F2NO and a molecular weight of 173.16 g/mol. Its IUPAC name is 2-(2,3-difluorophenoxy)ethanamine.

Molecular Properties

Compound Name2-(2,3-difluorophenoxy)ethanamine
PubChem CID63036211
Molecular FormulaC8H9F2NO
Molecular Weight173.16 g/mol
Exact Mass173.07
IUPAC Name2-(2,3-difluorophenoxy)ethanamine
SMILESNCCOc1cccc(F)c1F
InChIInChI=1S/C8H9F2NO/c9-6-2-1-3-7(8(6)10)12-5-4-11/h1-3H,4-5,11H2
InChIKeyJACRJZWMGNYVBO-UHFFFAOYSA-N
XLogP1.30
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.16
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[7-(2,3-difluorophenoxy)heptoxy]-2,3-difluorobenzene
CID 71446254
2-(3-bromo-2-fluorophenoxy)ethanamine;hydrochloride
CID 170912674
3-(2,3-difluorophenoxy)propan-1-ol
CID 63037951
4-(2,3-difluorophenoxy)butoxyphosphane
CID 59036591
1,2-difluoro-3-(2-methylsulfanylethoxy)benzene
CID 103907571
1-dodecoxy-2,3-difluorobenzene
CID 15854521
2-[2-(2-aminoethoxy)phenoxy]ethanamine
CID 2054448
CID 175374084
CID 175374084
1-[2-(2-chloroethoxy)ethoxy]-2,3-difluorobenzene
CID 63665653
1,2-difluoro-3-pent-4-ynoxybenzene
CID 115871030
2-[2-(2-fluoro-3-methylphenoxy)ethoxy]ethanamine
CID 107658319
4-(2,3-difluorophenoxy)butanehydrazide
CID 63568959

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluorophenoxy)ethanamine?
The IUPAC name of 2-(2,3-difluorophenoxy)ethanamine (CID 63036211) is 2-(2,3-difluorophenoxy)ethanamine.
What is the SMILES notation for 2-(2,3-difluorophenoxy)ethanamine?
The canonical SMILES for 2-(2,3-difluorophenoxy)ethanamine is NCCOc1cccc(F)c1F.
What is the InChIKey of 2-(2,3-difluorophenoxy)ethanamine?
The InChIKey is JACRJZWMGNYVBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F2NO/c9-6-2-1-3-7(8(6)10)12-5-4-11/h1-3H,4-5,11H2.
What are the key properties of 2-(2,3-difluorophenoxy)ethanamine?
2-(2,3-difluorophenoxy)ethanamine has a molecular weight of 173.16 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluorophenoxy)ethanamine is sourced from PubChem (CID 63036211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).