2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide

C14H22N2O3 — CID 61268758

IUPAC2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)COc1cc(OC)ccc1CCN
InChIInChI=1S/C14H22N2O3/c1-4-16(2)14(17)10-19-13-9-12(18-3)6-5-11(13)7-8-15/h5-6,9H,4,7-8,10,15H2,1-3H3
InChIKeyNGMRQKPRIKIGIU-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.05
Rot. Bonds7

About 2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide

2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide (PubChem CID 61268758) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide.

Molecular Properties

Compound Name2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide
PubChem CID61268758
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)COc1cc(OC)ccc1CCN
InChIInChI=1S/C14H22N2O3/c1-4-16(2)14(17)10-19-13-9-12(18-3)6-5-11(13)7-8-15/h5-6,9H,4,7-8,10,15H2,1-3H3
InChIKeyNGMRQKPRIKIGIU-UHFFFAOYSA-N
XLogP1.05
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-cyclopropyl-N-ethylacetamide
CID 61488645
2-(2-amino-5-methoxyphenoxy)-N-ethyl-N-methylacetamide
CID 102702283
N-ethyl-2-[5-methoxy-2-[(propan-2-ylamino)methyl]phenoxy]-N-methylacetamide
CID 61267271
2-[5-(2-aminoethyl)-2-methoxyphenoxy]-N-ethyl-N-methylacetamide
CID 54930640
2-[2-[ethyl(methyl)amino]-2-oxoethoxy]-5-methoxybenzoic acid
CID 43309744
2-[2-(2-chloroprop-2-enoxy)-4-methoxyphenyl]ethanamine
CID 61268017
methyl 3-[2-(2-aminoethyl)-5-methoxyphenoxy]-2,2-dimethylpropanoate
CID 79621787
3-[2-(2-aminoethyl)-5-methoxyphenoxy]-2,2-dimethylpropanoic acid
CID 79621891
2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-prop-2-ynylacetamide
CID 61268381
2-(2-butoxy-4-methoxyphenyl)ethanamine
CID 20985365
N,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide
CID 61269414
N-ethyl-2-[4-methoxy-2-(propylaminomethyl)phenoxy]-N-methylacetamide
CID 43309412

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide?
The IUPAC name of 2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide (CID 61268758) is 2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide.
What is the SMILES notation for 2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide?
The canonical SMILES for 2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide is CCN(C)C(=O)COc1cc(OC)ccc1CCN.
What is the InChIKey of 2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide?
The InChIKey is NGMRQKPRIKIGIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-4-16(2)14(17)10-19-13-9-12(18-3)6-5-11(13)7-8-15/h5-6,9H,4,7-8,10,15H2,1-3H3.
What are the key properties of 2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide?
2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide has a molecular weight of 266.34 g/mol, XLogP of 1.05, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide is sourced from PubChem (CID 61268758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).