2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol

C10H21NO4 — CID 66472309

IUPAC2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol
SMILESOCCN(CCO)CCC1OCCCO1
InChIInChI=1S/C10H21NO4/c12-6-4-11(5-7-13)3-2-10-14-8-1-9-15-10/h10,12-13H,1-9H2
InChIKeyCFJOIULJSZDPGS-UHFFFAOYSA-N
MW219.28 g/mol
LogP-0.57
Rot. Bonds7

About 2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol

2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol (PubChem CID 66472309) has the molecular formula C10H21NO4 and a molecular weight of 219.28 g/mol. Its IUPAC name is 2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol.

Molecular Properties

Compound Name2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol
PubChem CID66472309
Molecular FormulaC10H21NO4
Molecular Weight219.28 g/mol
Exact Mass219.15
IUPAC Name2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol
SMILESOCCN(CCO)CCC1OCCCO1
InChIInChI=1S/C10H21NO4/c12-6-4-11(5-7-13)3-2-10-14-8-1-9-15-10/h10,12-13H,1-9H2
InChIKeyCFJOIULJSZDPGS-UHFFFAOYSA-N
XLogP-0.57
TPSA62.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(1,3-dioxan-2-yl)ethyl-methylamino]ethanol
CID 66472112
N,N-bis(cyclopropylmethyl)-2-(1,3-dioxan-2-yl)ethanamine
CID 66472122
2-[2-(1,3-dioxolan-2-yl)ethyl]-1,3-dioxane
CID 91071611
3-[cyclobutyl-[2-(1,3-dioxan-2-yl)ethyl]amino]propan-1-ol
CID 102848652
2-[2-(1,3-dioxolan-2-yl)ethyl-methoxyamino]ethanol
CID 130645018
2-(1,3-dioxan-2-yl)ethanethiol
CID 6326934
2-[bis(2-hydroxyethyl)amino]ethanol;nickel(2+)
CID 159992570
2-[bis(2-hydroxyethyl)amino]ethanol;silane
CID 173402011
copper 2-[bis(2-hydroxyethyl)amino]ethanol
CID 18952570
2-[bis(2-hydroxyethyl)amino]ethanol;cobalt
CID 161104033
2-[bis(2-hydroxyethyl)amino]ethanol;iron(3+)
CID 22634755
2-[2-(1,3-dioxan-2-yl)ethylsulfanyl]-N,N-diethylethanamine
CID 66474168

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol?
The IUPAC name of 2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol (CID 66472309) is 2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol.
What is the SMILES notation for 2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol?
The canonical SMILES for 2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol is OCCN(CCO)CCC1OCCCO1.
What is the InChIKey of 2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol?
The InChIKey is CFJOIULJSZDPGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO4/c12-6-4-11(5-7-13)3-2-10-14-8-1-9-15-10/h10,12-13H,1-9H2.
What are the key properties of 2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol?
2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol has a molecular weight of 219.28 g/mol, XLogP of -0.57, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1,3-dioxan-2-yl)ethyl-(2-hydroxyethyl)amino]ethanol is sourced from PubChem (CID 66472309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).