2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol

C7H18N2O3 — CID 87109457

IUPAC2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol
SMILESCN(N)CCOCCOCCO
InChIInChI=1S/C7H18N2O3/c1-9(8)2-4-11-6-7-12-5-3-10/h10H,2-8H2,1H3
InChIKeyVOWSNPSSESZMJH-UHFFFAOYSA-N
MW178.23 g/mol
LogP-1.18
Rot. Bonds8

About 2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol

2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol (PubChem CID 87109457) has the molecular formula C7H18N2O3 and a molecular weight of 178.23 g/mol. Its IUPAC name is 2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol
PubChem CID87109457
Molecular FormulaC7H18N2O3
Molecular Weight178.23 g/mol
Exact Mass178.13
IUPAC Name2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol
SMILESCN(N)CCOCCOCCO
InChIInChI=1S/C7H18N2O3/c1-9(8)2-4-11-6-7-12-5-3-10/h10H,2-8H2,1H3
InChIKeyVOWSNPSSESZMJH-UHFFFAOYSA-N
XLogP-1.18
TPSA67.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 5-1.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 154730088
2-[2-(dimethylamino)ethoxy]ethanol
CID 158737336
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(dimethylamino)ethyl-methylamino]ethyl-methylamino]ethyl-methylamino]ethyl-methylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 89226278
ethane;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol
CID 159638520
2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 17472
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 14619695
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 14619703
2-[2-[2-[2-[2-[2-[2-[2-[bis(2-ethoxyethyl)amino]ethoxy]ethoxy]ethoxy]ethoxy]ethyl-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]amino]ethoxy]ethoxy]ethanol
CID 146492334
1-[ethyl-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]amino]ethanol
CID 123237316
2-[2-[ethyl-[2-(2-hydroxyethoxy)ethyl]amino]ethoxy]ethanol
CID 54156133
N,N-dimethylacetamide;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol
CID 175584179
2-[2-(2-ethoxyethoxy)ethyl-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]amino]ethanol
CID 90352000

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol?
The IUPAC name of 2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol (CID 87109457) is 2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol?
The canonical SMILES for 2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol is CN(N)CCOCCOCCO.
What is the InChIKey of 2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol?
The InChIKey is VOWSNPSSESZMJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O3/c1-9(8)2-4-11-6-7-12-5-3-10/h10H,2-8H2,1H3.
What are the key properties of 2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol?
2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol has a molecular weight of 178.23 g/mol, XLogP of -1.18, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[amino(methyl)amino]ethoxy]ethoxy]ethanol is sourced from PubChem (CID 87109457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).