2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol

C9H22N2O2 — CID 87792104

IUPAC2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol
SMILESCN(CCO)CC(C)(C)OCCN
InChIInChI=1S/C9H22N2O2/c1-9(2,13-7-4-10)8-11(3)5-6-12/h12H,4-8,10H2,1-3H3
InChIKeyLOKYXGWZQOZGPS-UHFFFAOYSA-N
MW190.29 g/mol
LogP-0.34
Rot. Bonds7

About 2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol

2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol (PubChem CID 87792104) has the molecular formula C9H22N2O2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol.

Molecular Properties

Compound Name2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol
PubChem CID87792104
Molecular FormulaC9H22N2O2
Molecular Weight190.29 g/mol
Exact Mass190.17
IUPAC Name2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol
SMILESCN(CCO)CC(C)(C)OCCN
InChIInChI=1S/C9H22N2O2/c1-9(2,13-7-4-10)8-11(3)5-6-12/h12H,4-8,10H2,1-3H3
InChIKeyLOKYXGWZQOZGPS-UHFFFAOYSA-N
XLogP-0.34
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol?
The IUPAC name of 2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol (CID 87792104) is 2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol.
What is the SMILES notation for 2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol?
The canonical SMILES for 2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol is CN(CCO)CC(C)(C)OCCN.
What is the InChIKey of 2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol?
The InChIKey is LOKYXGWZQOZGPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22N2O2/c1-9(2,13-7-4-10)8-11(3)5-6-12/h12H,4-8,10H2,1-3H3.
What are the key properties of 2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol?
2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol has a molecular weight of 190.29 g/mol, XLogP of -0.34, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol is sourced from PubChem (CID 87792104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).