1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol

C11H26N2O4 — CID 170282514

IUPAC1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol
SMILESCC(COCC(O)N(C)C)OCC(O)N(C)C
InChIInChI=1S/C11H26N2O4/c1-9(17-8-11(15)13(4)5)6-16-7-10(14)12(2)3/h9-11,14-15H,6-8H2,1-5H3
InChIKeyQNAWLLXAOSKDQD-UHFFFAOYSA-N
MW250.34 g/mol
LogP-0.83
Rot. Bonds9

About 1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol

1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol (PubChem CID 170282514) has the molecular formula C11H26N2O4 and a molecular weight of 250.34 g/mol. Its IUPAC name is 1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol.

Molecular Properties

Compound Name1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol
PubChem CID170282514
Molecular FormulaC11H26N2O4
Molecular Weight250.34 g/mol
Exact Mass250.19
IUPAC Name1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol
SMILESCC(COCC(O)N(C)C)OCC(O)N(C)C
InChIInChI=1S/C11H26N2O4/c1-9(17-8-11(15)13(4)5)6-16-7-10(14)12(2)3/h9-11,14-15H,6-8H2,1-5H3
InChIKeyQNAWLLXAOSKDQD-UHFFFAOYSA-N
XLogP-0.83
TPSA65.40 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 5-0.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]ethoxy]ethanol
CID 170282513
2-methyl-1-(2-methylpropoxy)propane;2-methyl-1-[2-(2-methylpropoxy)propoxy]propane;propane
CID 162007152
2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane
CID 58121620
2-ethoxy-1-(2-ethoxypropoxy)propane
CID 21277912
1-(dimethylamino)-3-[2-[2-(dimethylamino)-2-hydroxyethoxy]ethoxy]propan-2-ol
CID 58067985
[2-hydroxy-3-[1-(2-hydroxypropoxy)propan-2-yloxy]propyl]-trimethylazanium
CID 21106306
1-[2-[2-[1-(2-methoxypropoxy)propan-2-yloxy]ethoxy]propoxy]propan-2-ol
CID 122545429
2-(2-chloroethoxy)-1-[2-[2-(2-chloroethoxy)propoxy]propoxy]propane
CID 71321218
1-(2-hydroxypropoxy)propan-2-ol;1-[2-(2-hydroxypropoxy)propoxy]propan-2-ol;methane;2-methyloxirane
CID 159503599
1-[1-[1-[1-(2-methoxyethoxy)propan-2-yloxy]propan-2-yloxy]propan-2-yl-methylamino]propan-2-ol
CID 22947108
1-[2-[4-[2-(2-hydroxypropoxy)propoxy]butoxy]ethoxy]propan-2-ol
CID 163521633
(2S)-1-[(2S)-2-hydroxypropoxy]propan-2-ol
CID 6950271

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol?
The IUPAC name of 1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol (CID 170282514) is 1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol.
What is the SMILES notation for 1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol?
The canonical SMILES for 1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol is CC(COCC(O)N(C)C)OCC(O)N(C)C.
What is the InChIKey of 1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol?
The InChIKey is QNAWLLXAOSKDQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O4/c1-9(17-8-11(15)13(4)5)6-16-7-10(14)12(2)3/h9-11,14-15H,6-8H2,1-5H3.
What are the key properties of 1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol?
1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol has a molecular weight of 250.34 g/mol, XLogP of -0.83, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]propoxy]ethanol is sourced from PubChem (CID 170282514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).