ethane;2-[2-(ethylamino)ethylamino]ethanol

C8H22N2O — CID 156647808

IUPACethane;2-[2-(ethylamino)ethylamino]ethanol
SMILESCC.CCNCCNCCO
InChIInChI=1S/C6H16N2O.C2H6/c1-2-7-3-4-8-5-6-9;1-2/h7-9H,2-6H2,1H3;1-2H3
InChIKeyWBBZCOYDIQXYEE-UHFFFAOYSA-N
MW162.28 g/mol
LogP0.20
Rot. Bonds6

About ethane;2-[2-(ethylamino)ethylamino]ethanol

ethane;2-[2-(ethylamino)ethylamino]ethanol (PubChem CID 156647808) has the molecular formula C8H22N2O and a molecular weight of 162.28 g/mol. Its IUPAC name is ethane;2-[2-(ethylamino)ethylamino]ethanol.

Molecular Properties

Compound Nameethane;2-[2-(ethylamino)ethylamino]ethanol
PubChem CID156647808
Molecular FormulaC8H22N2O
Molecular Weight162.28 g/mol
Exact Mass162.17
IUPAC Nameethane;2-[2-(ethylamino)ethylamino]ethanol
SMILESCC.CCNCCNCCO
InChIInChI=1S/C6H16N2O.C2H6/c1-2-7-3-4-8-5-6-9;1-2/h7-9H,2-6H2,1H3;1-2H3
InChIKeyWBBZCOYDIQXYEE-UHFFFAOYSA-N
XLogP0.20
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.28
LogP ≤ 50.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(ethylamino)ethanol
CID 170923531
2-(ethylamino)ethanol;hydrate
CID 174456532
2-(ethylamino)ethanol;hydroxylamine
CID 159506848
2-(2-hydroxyethylamino)ethanol;propane
CID 142274456
2-[2-(2-hydroxyethylamino)ethylamino]ethanol;dihydrochloride
CID 87137347
carbamodithioic acid;2-(ethylamino)ethanol
CID 174237242
2-(dimethylamino)ethanol;2-(ethylamino)ethanol
CID 88639908
2-(ethylamino)ethanol;hexadecan-1-ol
CID 174880813
2-(propylamino)ethanol;hydrobromide
CID 175488073
ethanamine;2-(2-hydroxyethylamino)ethanol;hydrofluoride
CID 175606240
1-(ethylamino)ethanol;2-(ethylamino)ethanol
CID 157298760
2-[ethyl(2-hydroxyethyl)amino]ethanol;2-(2-hydroxyethylamino)ethanol
CID 159800308

Frequently Asked Questions

What is the IUPAC name of ethane;2-[2-(ethylamino)ethylamino]ethanol?
The IUPAC name of ethane;2-[2-(ethylamino)ethylamino]ethanol (CID 156647808) is ethane;2-[2-(ethylamino)ethylamino]ethanol.
What is the SMILES notation for ethane;2-[2-(ethylamino)ethylamino]ethanol?
The canonical SMILES for ethane;2-[2-(ethylamino)ethylamino]ethanol is CC.CCNCCNCCO.
What is the InChIKey of ethane;2-[2-(ethylamino)ethylamino]ethanol?
The InChIKey is WBBZCOYDIQXYEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N2O.C2H6/c1-2-7-3-4-8-5-6-9;1-2/h7-9H,2-6H2,1H3;1-2H3.
What are the key properties of ethane;2-[2-(ethylamino)ethylamino]ethanol?
ethane;2-[2-(ethylamino)ethylamino]ethanol has a molecular weight of 162.28 g/mol, XLogP of 0.20, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-[2-(ethylamino)ethylamino]ethanol is sourced from PubChem (CID 156647808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).