2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid

C16H19NO3 — CID 61011595

IUPAC2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid
SMILESCCN(CCOc1ccc2ccccc2c1)CC(=O)O
InChIInChI=1S/C16H19NO3/c1-2-17(12-16(18)19)9-10-20-15-8-7-13-5-3-4-6-14(13)11-15/h3-8,11H,2,9-10,12H2,1H3,(H,18,19)
InChIKeyAJEUSNKAHFNDDE-UHFFFAOYSA-N
MW273.33 g/mol
LogP2.63
Rot. Bonds7

About 2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid

2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid (PubChem CID 61011595) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is 2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid
PubChem CID61011595
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC Name2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid
SMILESCCN(CCOc1ccc2ccccc2c1)CC(=O)O
InChIInChI=1S/C16H19NO3/c1-2-17(12-16(18)19)9-10-20-15-8-7-13-5-3-4-6-14(13)11-15/h3-8,11H,2,9-10,12H2,1H3,(H,18,19)
InChIKeyAJEUSNKAHFNDDE-UHFFFAOYSA-N
XLogP2.63
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[ethyl(2-naphthalen-2-yloxyethyl)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-[2-naphthalen-2-yloxyethyl(propyl)amino]acetic acid
CID 61007729
N,N-diethyl-4-naphthalen-2-yloxybutan-1-amine
CID 5333118
3-[methyl(3-naphthalen-2-yloxypropyl)amino]propanoic acid
CID 82224138
3-[2-(diethylamino)ethoxy]benzo[b]acridine-12-carboxylic acid
CID 22071081
2-[2-(4-methylphenoxy)ethyl-propylamino]acetic acid
CID 61007102
7-naphthalen-2-yloxyheptanoic acid
CID 39371628
4-[2-(diethylamino)ethoxy]-2-ethylbenzoic acid
CID 69431703
2,2-dimethyl-4-naphthalen-2-yloxybutanoic acid
CID 65248421
2-[2-(3-bromophenoxy)ethyl-[2-(dimethylamino)ethyl]amino]acetic acid
CID 107425881
N,N-diethyl-2-(2-phenylquinolin-7-yl)oxyethanamine
CID 154372459
(E)-3-[3-[2-(diethylamino)ethoxy]phenyl]prop-2-enoic acid
CID 42200566
2-[carboxymethyl(3-phenoxypropyl)amino]acetic acid
CID 63644970

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid?
The IUPAC name of 2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid (CID 61011595) is 2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid.
What is the SMILES notation for 2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid?
The canonical SMILES for 2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid is CCN(CCOc1ccc2ccccc2c1)CC(=O)O.
What is the InChIKey of 2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid?
The InChIKey is AJEUSNKAHFNDDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c1-2-17(12-16(18)19)9-10-20-15-8-7-13-5-3-4-6-14(13)11-15/h3-8,11H,2,9-10,12H2,1H3,(H,18,19).
What are the key properties of 2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid?
2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid has a molecular weight of 273.33 g/mol, XLogP of 2.63, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(2-naphthalen-2-yloxyethyl)amino]acetic acid is sourced from PubChem (CID 61011595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).