2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide

C16H17FN2O2 — CID 107700615

IUPAC2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide
SMILESNCCc1cc(F)ccc1OCC(=O)Nc1ccccc1
InChIInChI=1S/C16H17FN2O2/c17-13-6-7-15(12(10-13)8-9-18)21-11-16(20)19-14-4-2-1-3-5-14/h1-7,10H,8-9,11,18H2,(H,19,20)
InChIKeyQDZJSKWBMLEDDR-UHFFFAOYSA-N
MW288.32 g/mol
LogP2.34
Rot. Bonds6

About 2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide

2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide (PubChem CID 107700615) has the molecular formula C16H17FN2O2 and a molecular weight of 288.32 g/mol. Its IUPAC name is 2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide.

Molecular Properties

Compound Name2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide
PubChem CID107700615
Molecular FormulaC16H17FN2O2
Molecular Weight288.32 g/mol
Exact Mass288.13
IUPAC Name2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide
SMILESNCCc1cc(F)ccc1OCC(=O)Nc1ccccc1
InChIInChI=1S/C16H17FN2O2/c17-13-6-7-15(12(10-13)8-9-18)21-11-16(20)19-14-4-2-1-3-5-14/h1-7,10H,8-9,11,18H2,(H,19,20)
InChIKeyQDZJSKWBMLEDDR-UHFFFAOYSA-N
XLogP2.34
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.32
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-(2-aminoethyl)-4-chlorophenoxy]-N-phenylacetamide
CID 60906318
2-[2-(2-aminoethyl)phenoxy]-N-(4-bromophenyl)acetamide
CID 60905403
2-(2,4-difluorophenoxy)-N-(4-fluorophenyl)acetamide
CID 580280
2-[2-(aminomethyl)-4-fluorophenoxy]-N-(2-methylphenyl)acetamide
CID 107694923
2-[2-(aminomethyl)-4-methylphenoxy]-N-(4-fluorophenyl)acetamide
CID 63322519
2-[2-(aminomethyl)-5-chlorophenoxy]-N-phenylacetamide
CID 114322295
2-[2-(2-aminoethyl)-4-fluorophenoxy]-N,N-diethylacetamide
CID 107700208
2-(2-aminophenoxy)-N-(4-fluorophenyl)acetamide
CID 16789642
2-(3-fluorophenoxy)-N-phenylacetamide
CID 2709732
N-(3-chlorophenyl)-2-(2,4-difluorophenoxy)acetamide
CID 17173171
4-[2-(2-aminoethyl)-4-fluorophenoxy]-N-methylbutanamide
CID 107700545
2-(4-amino-2-fluoro-5-methylphenoxy)-N-phenylacetamide
CID 114415725

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide?
The IUPAC name of 2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide (CID 107700615) is 2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide.
What is the SMILES notation for 2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide?
The canonical SMILES for 2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide is NCCc1cc(F)ccc1OCC(=O)Nc1ccccc1.
What is the InChIKey of 2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide?
The InChIKey is QDZJSKWBMLEDDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O2/c17-13-6-7-15(12(10-13)8-9-18)21-11-16(20)19-14-4-2-1-3-5-14/h1-7,10H,8-9,11,18H2,(H,19,20).
What are the key properties of 2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide?
2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide has a molecular weight of 288.32 g/mol, XLogP of 2.34, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-phenylacetamide is sourced from PubChem (CID 107700615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).