3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine

C11H25NO3 — CID 103406340

IUPAC3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine
SMILESCOCCOCCCOCC(C)(C)CN
InChIInChI=1S/C11H25NO3/c1-11(2,9-12)10-15-6-4-5-14-8-7-13-3/h4-10,12H2,1-3H3
InChIKeyNYPXVUDIXDJSNN-UHFFFAOYSA-N
MW219.32 g/mol
LogP1.04
Rot. Bonds10

About 3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine

3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine (PubChem CID 103406340) has the molecular formula C11H25NO3 and a molecular weight of 219.32 g/mol. Its IUPAC name is 3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine
PubChem CID103406340
Molecular FormulaC11H25NO3
Molecular Weight219.32 g/mol
Exact Mass219.18
IUPAC Name3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine
SMILESCOCCOCCCOCC(C)(C)CN
InChIInChI=1S/C11H25NO3/c1-11(2,9-12)10-15-6-4-5-14-8-7-13-3/h4-10,12H2,1-3H3
InChIKeyNYPXVUDIXDJSNN-UHFFFAOYSA-N
XLogP1.04
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.32
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-Propanamine, 3-[2-(2-methoxyethoxy)ethoxy]-
CID 58741575
3-(2,2-Dimethylpropoxy)propan-1-amine
CID 71773694
2,5,8,11-Tetraoxatetradecan-14-amine
CID 104560323
1-Propanamine, 3-(2-ethoxyethoxy)-
CID 120038
3,3'-((2,2-Dimethylpropane-1,3-diyl)bis(oxy))bispropylamine
CID 81332
3-(2-Methoxyethoxy)propylazanium
CID 7019638
3-[2-(2-Ethoxyethoxy)ethoxy]propan-1-amine
CID 55250334
3-[2-(2-Butoxyethoxy)ethoxy]propan-1-amine
CID 19818333
3-[2-[2-[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-1-amine
CID 20067991
3-[3-(3-Aminopropoxy)-2-(3-aminopropoxymethyl)-2-methylpropoxy]propan-1-amine
CID 20502965
3-[2-(3-Amino-2-methylpropoxy)ethoxy]-2-methylpropan-1-amine
CID 20541464
3-(2-Butoxyethoxy)propan-1-amine
CID 21432831

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine?
The IUPAC name of 3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine (CID 103406340) is 3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine.
What is the SMILES notation for 3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine?
The canonical SMILES for 3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine is COCCOCCCOCC(C)(C)CN.
What is the InChIKey of 3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine?
The InChIKey is NYPXVUDIXDJSNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO3/c1-11(2,9-12)10-15-6-4-5-14-8-7-13-3/h4-10,12H2,1-3H3.
What are the key properties of 3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine?
3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine has a molecular weight of 219.32 g/mol, XLogP of 1.04, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine is sourced from PubChem (CID 103406340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).