3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline

C15H25NO4 — CID 166462130

IUPAC3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline
SMILESCOCCOCCN(CCOC)c1cccc(OC)c1
InChIInChI=1S/C15H25NO4/c1-17-9-7-16(8-10-20-12-11-18-2)14-5-4-6-15(13-14)19-3/h4-6,13H,7-12H2,1-3H3
InChIKeyHVAXCWCCNIERNF-UHFFFAOYSA-N
MW283.37 g/mol
LogP1.81
Rot. Bonds11

About 3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline

3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline (PubChem CID 166462130) has the molecular formula C15H25NO4 and a molecular weight of 283.37 g/mol. Its IUPAC name is 3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline.

Molecular Properties

Compound Name3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline
PubChem CID166462130
Molecular FormulaC15H25NO4
Molecular Weight283.37 g/mol
Exact Mass283.18
IUPAC Name3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline
SMILESCOCCOCCN(CCOC)c1cccc(OC)c1
InChIInChI=1S/C15H25NO4/c1-17-9-7-16(8-10-20-12-11-18-2)14-5-4-6-15(13-14)19-3/h4-6,13H,7-12H2,1-3H3
InChIKeyHVAXCWCCNIERNF-UHFFFAOYSA-N
XLogP1.81
TPSA40.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-methoxy-N,N-bis[2-(2-methoxyethoxy)ethyl]aniline
CID 156565420
N-ethyl-3-methoxy-N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]aniline
CID 156571603
N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)-3-methylaniline
CID 124925556
3-[bis[2-(2-methoxyethoxy)ethyl]amino]phenol
CID 59211296
N,N-bis[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]aniline
CID 169196905
3-bromo-N,N-bis(2-methoxyethyl)aniline
CID 146003902
3-N,3-N-bis(2-methoxyethyl)benzene-1,3-diamine
CID 43587927
3-[N-(2-cyanoethyl)-3-methoxyanilino]propanenitrile
CID 4243106
N-[2-(2-aminoethoxy)ethyl]-3-methoxy-N-methylaniline
CID 79479150
N-butyl-N-[2-(2-methoxyethoxy)ethyl]aniline
CID 164933283
N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-N'-phenylpropane-1,3-diamine
CID 104561042
3-methoxy-N-[3-(2-methoxyethoxy)propyl]aniline
CID 103409360

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline?
The IUPAC name of 3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline (CID 166462130) is 3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline.
What is the SMILES notation for 3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline?
The canonical SMILES for 3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline is COCCOCCN(CCOC)c1cccc(OC)c1.
What is the InChIKey of 3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline?
The InChIKey is HVAXCWCCNIERNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO4/c1-17-9-7-16(8-10-20-12-11-18-2)14-5-4-6-15(13-14)19-3/h4-6,13H,7-12H2,1-3H3.
What are the key properties of 3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline?
3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline has a molecular weight of 283.37 g/mol, XLogP of 1.81, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[2-(2-methoxyethoxy)ethyl]-N-(2-methoxyethyl)aniline is sourced from PubChem (CID 166462130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).