2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol

C9H22N2O2 — CID 87217560

IUPAC2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol
SMILESCC(CN(CCO)CCO)N(C)C
InChIInChI=1S/C9H22N2O2/c1-9(10(2)3)8-11(4-6-12)5-7-13/h9,12-13H,4-8H2,1-3H3
InChIKeyRIFFMLHCOZICGB-UHFFFAOYSA-N
MW190.29 g/mol
LogP-0.78
Rot. Bonds7

About 2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol

2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol (PubChem CID 87217560) has the molecular formula C9H22N2O2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol.

Molecular Properties

Compound Name2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol
PubChem CID87217560
Molecular FormulaC9H22N2O2
Molecular Weight190.29 g/mol
Exact Mass190.17
IUPAC Name2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol
SMILESCC(CN(CCO)CCO)N(C)C
InChIInChI=1S/C9H22N2O2/c1-9(10(2)3)8-11(4-6-12)5-7-13/h9,12-13H,4-8H2,1-3H3
InChIKeyRIFFMLHCOZICGB-UHFFFAOYSA-N
XLogP-0.78
TPSA46.94 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 ≤ 5-0.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol?
The IUPAC name of 2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol (CID 87217560) is 2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol.
What is the SMILES notation for 2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol?
The canonical SMILES for 2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol is CC(CN(CCO)CCO)N(C)C.
What is the InChIKey of 2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol?
The InChIKey is RIFFMLHCOZICGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22N2O2/c1-9(10(2)3)8-11(4-6-12)5-7-13/h9,12-13H,4-8H2,1-3H3.
What are the key properties of 2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol?
2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol has a molecular weight of 190.29 g/mol, XLogP of -0.78, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)propyl-(2-hydroxyethyl)amino]ethanol is sourced from PubChem (CID 87217560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).