3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine

C11H25NO4 — CID 104561644

IUPAC3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine
SMILESCOCCCNCCOCCOCCOC
InChIInChI=1S/C11H25NO4/c1-13-6-3-4-12-5-7-15-10-11-16-9-8-14-2/h12H,3-11H2,1-2H3
InChIKeyGMUJDNVKKLICSB-UHFFFAOYSA-N
MW235.32 g/mol
LogP0.29
Rot. Bonds13

About 3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine

3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine (PubChem CID 104561644) has the molecular formula C11H25NO4 and a molecular weight of 235.32 g/mol. Its IUPAC name is 3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine.

Molecular Properties

Compound Name3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine
PubChem CID104561644
Molecular FormulaC11H25NO4
Molecular Weight235.32 g/mol
Exact Mass235.18
IUPAC Name3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine
SMILESCOCCCNCCOCCOCCOC
InChIInChI=1S/C11H25NO4/c1-13-6-3-4-12-5-7-15-10-11-16-9-8-14-2/h12H,3-11H2,1-2H3
InChIKeyGMUJDNVKKLICSB-UHFFFAOYSA-N
XLogP0.29
TPSA48.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.32
LogP ≤ 50.29
H-Bond Donors ≤ 51
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-[2-(2-propoxyethoxy)ethyl]propan-1-amine
CID 63685704
N-[2-(2-ethoxyethoxy)ethyl]-3-methoxypropan-1-amine
CID 62565586
2-methoxy-N-[2-[2-[2-[2-[2-(2-methoxyethylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]ethanamine
CID 102574909
bis(1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane);2-methoxy-N-(2-methoxyethyl)ethanamine
CID 87204076
3-fluoro-N-[2-(2-methoxyethoxy)ethyl]propan-1-amine
CID 81106817
N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3-propan-2-yloxypropan-1-amine
CID 113427495
N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine
CID 63492773
N-(2-hexoxyethyl)-3-methoxypropan-1-amine
CID 62599714
6-[2-(2-methoxyethoxy)ethylamino]hexan-1-ol
CID 107703333
3-(2-chloroethoxy)-N-[2-(3-methoxypropoxy)ethyl]propan-1-amine
CID 106306027
6-chloro-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]hexan-1-amine
CID 114008238
2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine
CID 130284119

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine?
The IUPAC name of 3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine (CID 104561644) is 3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine.
What is the SMILES notation for 3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine?
The canonical SMILES for 3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine is COCCCNCCOCCOCCOC.
What is the InChIKey of 3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine?
The InChIKey is GMUJDNVKKLICSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO4/c1-13-6-3-4-12-5-7-15-10-11-16-9-8-14-2/h12H,3-11H2,1-2H3.
What are the key properties of 3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine?
3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine has a molecular weight of 235.32 g/mol, XLogP of 0.29, 13 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine is sourced from PubChem (CID 104561644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).