2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide

C10H13FN2O2 — CID 63066360

IUPAC2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide
SMILESCC(N)c1ccc(F)cc1OCC(N)=O
InChIInChI=1S/C10H13FN2O2/c1-6(12)8-3-2-7(11)4-9(8)15-5-10(13)14/h2-4,6H,5,12H2,1H3,(H2,13,14)
InChIKeyDRJNBZWOASYGQV-UHFFFAOYSA-N
MW212.22 g/mol
LogP0.71
Rot. Bonds4

About 2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide

2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide (PubChem CID 63066360) has the molecular formula C10H13FN2O2 and a molecular weight of 212.22 g/mol. Its IUPAC name is 2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide.

Molecular Properties

Compound Name2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide
PubChem CID63066360
Molecular FormulaC10H13FN2O2
Molecular Weight212.22 g/mol
Exact Mass212.10
IUPAC Name2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide
SMILESCC(N)c1ccc(F)cc1OCC(N)=O
InChIInChI=1S/C10H13FN2O2/c1-6(12)8-3-2-7(11)4-9(8)15-5-10(13)14/h2-4,6H,5,12H2,1H3,(H2,13,14)
InChIKeyDRJNBZWOASYGQV-UHFFFAOYSA-N
XLogP0.71
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.22
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-[(1S)-1-aminoethyl]-5-fluorophenoxy]-N-methylacetamide
CID 78936103
2-[2-(1-aminoethyl)-5-fluorophenoxy]-N-(3-methylbutan-2-yl)acetamide
CID 63064235
2-[2-[(1S)-1-aminoethyl]-5-methylphenoxy]acetamide
CID 78946963
2-[2-[(1R)-1-aminoethyl]-5-fluorophenoxy]-N-(2-methylpropyl)acetamide
CID 63368195
2-[2-(1-aminoethyl)-5-bromophenoxy]acetamide
CID 102946264
2-[2-[(1S)-1-aminoethyl]-5-fluorophenoxy]-N-pentan-2-ylacetamide
CID 78935876
3-[2-(1-aminoethyl)-5-fluorophenoxy]-2,2-dimethylpropanoic acid
CID 79629205
1-[2-[(1S)-1-aminoethyl]-5-fluorophenoxy]-2-methylpropan-2-ol
CID 78935976
2-[2-[(1R)-1-aminoethyl]-5-fluorophenoxy]-N-(2,2,2-trifluoroethyl)acetamide
CID 78935841
2-[2-[(1R)-1-aminoethyl]-5-fluorophenoxy]-N-(cyanomethyl)acetamide
CID 78935744
1-[2-[(1R)-1-aminoethyl]-5-fluorophenoxy]propan-2-ol
CID 63368001
2-[2-(1-aminoethyl)-5-fluorophenoxy]-N-(2-methylbutan-2-yl)acetamide
CID 63066536

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide?
The IUPAC name of 2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide (CID 63066360) is 2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide.
What is the SMILES notation for 2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide?
The canonical SMILES for 2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide is CC(N)c1ccc(F)cc1OCC(N)=O.
What is the InChIKey of 2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide?
The InChIKey is DRJNBZWOASYGQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O2/c1-6(12)8-3-2-7(11)4-9(8)15-5-10(13)14/h2-4,6H,5,12H2,1H3,(H2,13,14).
What are the key properties of 2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide?
2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide has a molecular weight of 212.22 g/mol, XLogP of 0.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-aminoethyl)-5-fluorophenoxy]acetamide is sourced from PubChem (CID 63066360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).