2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid

C15H24N2O4 — CID 107425771

IUPAC2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid
SMILESCOc1ccccc1OCCN(CCN(C)C)CC(=O)O
InChIInChI=1S/C15H24N2O4/c1-16(2)8-9-17(12-15(18)19)10-11-21-14-7-5-4-6-13(14)20-3/h4-7H,8-12H2,1-3H3,(H,18,19)
InChIKeyGAPDGEPTUVZCES-UHFFFAOYSA-N
MW296.37 g/mol
LogP1.02
Rot. Bonds10

About 2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid

2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid (PubChem CID 107425771) has the molecular formula C15H24N2O4 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid
PubChem CID107425771
Molecular FormulaC15H24N2O4
Molecular Weight296.37 g/mol
Exact Mass296.17
IUPAC Name2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid
SMILESCOc1ccccc1OCCN(CCN(C)C)CC(=O)O
InChIInChI=1S/C15H24N2O4/c1-16(2)8-9-17(12-15(18)19)10-11-21-14-7-5-4-6-13(14)20-3/h4-7H,8-12H2,1-3H3,(H,18,19)
InChIKeyGAPDGEPTUVZCES-UHFFFAOYSA-N
XLogP1.02
TPSA62.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid 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-[carboxymethyl-[2-(2-chlorophenoxy)ethyl]amino]acetic acid
CID 63646826
2-[2-(3-bromophenoxy)ethyl-[2-(dimethylamino)ethyl]amino]acetic acid
CID 107425881
2-[2-(dimethylamino)ethyl-[(2-hydroxy-3-methoxyphenyl)methyl]amino]acetic acid
CID 107426429
2-[2-(2-chlorophenoxy)ethyl-propylamino]acetic acid
CID 54899208
2-[2-(dimethylamino)ethyl-[1-(2-methoxyphenyl)ethyl]amino]acetic acid
CID 107426423
2-[2-methoxyethyl-[2-(2-methoxyphenoxy)ethyl]amino]ethanol
CID 115613810
2-amino-N-[2-(2-methoxyphenoxy)ethyl]-N-methylacetamide;hydrochloride
CID 119294047
11-(2-methoxyphenoxy)undecanoic acid
CID 54541327
2-[4-[2-[2-[2-[bis(carboxymethyl)amino]ethoxy]phenoxy]ethyl]-7,10-bis(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
CID 54672557
2-[carboxymethyl(3-phenoxypropyl)amino]acetic acid
CID 63644970
3-(2-methoxyphenoxy)propanoyl chloride
CID 82040752
2-[2-(dimethylamino)ethyl-(3-phenylbutyl)amino]acetic acid
CID 107426148

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid?
The IUPAC name of 2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid (CID 107425771) is 2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid.
What is the SMILES notation for 2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid?
The canonical SMILES for 2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid is COc1ccccc1OCCN(CCN(C)C)CC(=O)O.
What is the InChIKey of 2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid?
The InChIKey is GAPDGEPTUVZCES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4/c1-16(2)8-9-17(12-15(18)19)10-11-21-14-7-5-4-6-13(14)20-3/h4-7H,8-12H2,1-3H3,(H,18,19).
What are the key properties of 2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid?
2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid has a molecular weight of 296.37 g/mol, XLogP of 1.02, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethyl-[2-(2-methoxyphenoxy)ethyl]amino]acetic acid is sourced from PubChem (CID 107425771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).