2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide

C15H24N2O3 — CID 60906019

IUPAC2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide
SMILESCCOc1cccc(CCN)c1OCC(=O)N(C)CC
InChIInChI=1S/C15H24N2O3/c1-4-17(3)14(18)11-20-15-12(9-10-16)7-6-8-13(15)19-5-2/h6-8H,4-5,9-11,16H2,1-3H3
InChIKeyKWPWZWSDDUGNQD-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.44
Rot. Bonds8

About 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide

2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide (PubChem CID 60906019) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide.

Molecular Properties

Compound Name2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide
PubChem CID60906019
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide
SMILESCCOc1cccc(CCN)c1OCC(=O)N(C)CC
InChIInChI=1S/C15H24N2O3/c1-4-17(3)14(18)11-20-15-12(9-10-16)7-6-8-13(15)19-5-2/h6-8H,4-5,9-11,16H2,1-3H3
InChIKeyKWPWZWSDDUGNQD-UHFFFAOYSA-N
XLogP1.44
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(2-aminoethyl)-6-chlorophenoxy]-N-ethyl-N-methylacetamide
CID 112615060
2-[4-(2-aminoethyl)-2-ethoxyphenoxy]-N-ethyl-N-methylacetamide
CID 60906427
2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide
CID 54930374
2-(3-ethoxy-2-pentoxyphenyl)ethanamine
CID 54930821
2-[2-(2-aminoethyl)-6-ethoxyphenoxy]butanoic acid
CID 64660569
2-[3-ethoxy-2-(3-methoxypropoxy)phenyl]ethanamine
CID 54935377
2-[2-(2-aminoethyl)-6-ethoxyphenoxy]acetonitrile
CID 60905803
2-(3-ethoxy-2-heptoxyphenyl)ethanamine
CID 60905453
2-[3-ethoxy-2-(3-ethylsulfonylpropoxy)phenyl]ethanamine
CID 65095267
2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide
CID 61268758
2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-cyclopropylpropanamide
CID 60905806
2-[2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]ethanamine
CID 60905689

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide?
The IUPAC name of 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide (CID 60906019) is 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide.
What is the SMILES notation for 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide?
The canonical SMILES for 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide is CCOc1cccc(CCN)c1OCC(=O)N(C)CC.
What is the InChIKey of 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide?
The InChIKey is KWPWZWSDDUGNQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-4-17(3)14(18)11-20-15-12(9-10-16)7-6-8-13(15)19-5-2/h6-8H,4-5,9-11,16H2,1-3H3.
What are the key properties of 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide?
2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide has a molecular weight of 280.37 g/mol, XLogP of 1.44, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide is sourced from PubChem (CID 60906019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).