2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol

C10H24N2O2 — CID 63070050

IUPAC2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol
SMILESCCCN(CCO)CC(CN)OCC
InChIInChI=1S/C10H24N2O2/c1-3-5-12(6-7-13)9-10(8-11)14-4-2/h10,13H,3-9,11H2,1-2H3
InChIKeyQMWMPXIRNHBYCZ-UHFFFAOYSA-N
MW204.31 g/mol
LogP0.05
Rot. Bonds9

About 2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol

2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol (PubChem CID 63070050) has the molecular formula C10H24N2O2 and a molecular weight of 204.31 g/mol. Its IUPAC name is 2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol.

Molecular Properties

Compound Name2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol
PubChem CID63070050
Molecular FormulaC10H24N2O2
Molecular Weight204.31 g/mol
Exact Mass204.18
IUPAC Name2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol
SMILESCCCN(CCO)CC(CN)OCC
InChIInChI=1S/C10H24N2O2/c1-3-5-12(6-7-13)9-10(8-11)14-4-2/h10,13H,3-9,11H2,1-2H3
InChIKeyQMWMPXIRNHBYCZ-UHFFFAOYSA-N
XLogP0.05
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol?
The IUPAC name of 2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol (CID 63070050) is 2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol.
What is the SMILES notation for 2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol?
The canonical SMILES for 2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol is CCCN(CCO)CC(CN)OCC.
What is the InChIKey of 2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol?
The InChIKey is QMWMPXIRNHBYCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O2/c1-3-5-12(6-7-13)9-10(8-11)14-4-2/h10,13H,3-9,11H2,1-2H3.
What are the key properties of 2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol?
2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol has a molecular weight of 204.31 g/mol, XLogP of 0.05, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-2-ethoxypropyl)-propylamino]ethanol is sourced from PubChem (CID 63070050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).