2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide

C14H22N2O3 — CID 54930374

IUPAC2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide
SMILESCCOc1cccc(CCN)c1OC(C)C(=O)NC
InChIInChI=1S/C14H22N2O3/c1-4-18-12-7-5-6-11(8-9-15)13(12)19-10(2)14(17)16-3/h5-7,10H,4,8-9,15H2,1-3H3,(H,16,17)
InChIKeyLWYUNCCTXXMVFK-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.10
Rot. Bonds7

About 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide

2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide (PubChem CID 54930374) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide.

Molecular Properties

Compound Name2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide
PubChem CID54930374
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide
SMILESCCOc1cccc(CCN)c1OC(C)C(=O)NC
InChIInChI=1S/C14H22N2O3/c1-4-18-12-7-5-6-11(8-9-15)13(12)19-10(2)14(17)16-3/h5-7,10H,4,8-9,15H2,1-3H3,(H,16,17)
InChIKeyLWYUNCCTXXMVFK-UHFFFAOYSA-N
XLogP1.10
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-cyclopropylpropanamide
CID 60905806
2-[2-(2-aminoethyl)-6-ethoxyphenoxy]butanoic acid
CID 64660569
2-[2-(aminomethyl)-6-ethoxyphenoxy]-N-butan-2-ylpropanamide
CID 43174613
2-[2-(aminomethyl)-6-ethoxyphenoxy]propanamide
CID 43366644
2-[2-(2-aminoethyl)-6-methoxyphenoxy]-N-butylpropanamide
CID 60904970
2-[2-(2-aminoethyl)-6-methoxyphenoxy]-N-cyclopropylpropanamide
CID 60904735
2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-ethyl-N-methylacetamide
CID 60906019
2-[2-(aminomethyl)-6-fluorophenoxy]-N-methylpropanamide
CID 112608112
2-[2-(2-aminoethyl)-6-chlorophenoxy]-N-ethylpropanamide
CID 112615083
2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide
CID 115957684
(2S)-2-(2-ethylphenoxy)-N-methylpropanamide
CID 28577058
2-[2-(2-aminoethyl)-6-bromophenoxy]-N-propylpropanamide
CID 61391964

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide?
The IUPAC name of 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide (CID 54930374) is 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide.
What is the SMILES notation for 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide?
The canonical SMILES for 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide is CCOc1cccc(CCN)c1OC(C)C(=O)NC.
What is the InChIKey of 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide?
The InChIKey is LWYUNCCTXXMVFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-4-18-12-7-5-6-11(8-9-15)13(12)19-10(2)14(17)16-3/h5-7,10H,4,8-9,15H2,1-3H3,(H,16,17).
What are the key properties of 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide?
2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide has a molecular weight of 266.34 g/mol, XLogP of 1.10, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide is sourced from PubChem (CID 54930374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).