2-[4-(1-aminoethyl)phenoxy]acetamide

C10H14N2O2 — CID 16796134

IUPAC2-[4-(1-aminoethyl)phenoxy]acetamide
SMILESCC(N)c1ccc(OCC(N)=O)cc1
InChIInChI=1S/C10H14N2O2/c1-7(11)8-2-4-9(5-3-8)14-6-10(12)13/h2-5,7H,6,11H2,1H3,(H2,12,13)
InChIKeyXWPBWRIDGFUYLO-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.57
Rot. Bonds4

About 2-[4-(1-aminoethyl)phenoxy]acetamide

2-[4-(1-aminoethyl)phenoxy]acetamide (PubChem CID 16796134) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-[4-(1-aminoethyl)phenoxy]acetamide.

Molecular Properties

Compound Name2-[4-(1-aminoethyl)phenoxy]acetamide
PubChem CID16796134
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name2-[4-(1-aminoethyl)phenoxy]acetamide
SMILESCC(N)c1ccc(OCC(N)=O)cc1
InChIInChI=1S/C10H14N2O2/c1-7(11)8-2-4-9(5-3-8)14-6-10(12)13/h2-5,7H,6,11H2,1H3,(H2,12,13)
InChIKeyXWPBWRIDGFUYLO-UHFFFAOYSA-N
XLogP0.57
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-aminoethyl)phenoxy]acetamide?
The IUPAC name of 2-[4-(1-aminoethyl)phenoxy]acetamide (CID 16796134) is 2-[4-(1-aminoethyl)phenoxy]acetamide.
What is the SMILES notation for 2-[4-(1-aminoethyl)phenoxy]acetamide?
The canonical SMILES for 2-[4-(1-aminoethyl)phenoxy]acetamide is CC(N)c1ccc(OCC(N)=O)cc1.
What is the InChIKey of 2-[4-(1-aminoethyl)phenoxy]acetamide?
The InChIKey is XWPBWRIDGFUYLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-7(11)8-2-4-9(5-3-8)14-6-10(12)13/h2-5,7H,6,11H2,1H3,(H2,12,13).
What are the key properties of 2-[4-(1-aminoethyl)phenoxy]acetamide?
2-[4-(1-aminoethyl)phenoxy]acetamide has a molecular weight of 194.23 g/mol, XLogP of 0.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-aminoethyl)phenoxy]acetamide is sourced from PubChem (CID 16796134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).