2-(dimethylamino)ethanol;2-(ethylamino)ethanol

C8H22N2O2 — CID 88639908

IUPAC2-(dimethylamino)ethanol;2-(ethylamino)ethanol
SMILESCCNCCO.CN(C)CCO
InChIInChI=1S/2C4H11NO/c1-5(2)3-4-6;1-2-5-3-4-6/h6H,3-4H2,1-2H3;5-6H,2-4H2,1H3
InChIKeyRJAVNRLDHJKLDN-UHFFFAOYSA-N
MW178.28 g/mol
LogP-0.87
Rot. Bonds5

About 2-(dimethylamino)ethanol;2-(ethylamino)ethanol

2-(dimethylamino)ethanol;2-(ethylamino)ethanol (PubChem CID 88639908) has the molecular formula C8H22N2O2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 2-(dimethylamino)ethanol;2-(ethylamino)ethanol.

Molecular Properties

Compound Name2-(dimethylamino)ethanol;2-(ethylamino)ethanol
PubChem CID88639908
Molecular FormulaC8H22N2O2
Molecular Weight178.28 g/mol
Exact Mass178.17
IUPAC Name2-(dimethylamino)ethanol;2-(ethylamino)ethanol
SMILESCCNCCO.CN(C)CCO
InChIInChI=1S/2C4H11NO/c1-5(2)3-4-6;1-2-5-3-4-6/h6H,3-4H2,1-2H3;5-6H,2-4H2,1H3
InChIKeyRJAVNRLDHJKLDN-UHFFFAOYSA-N
XLogP-0.87
TPSA55.73 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 5-0.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(dimethylamino)ethanol;2-(ethylamino)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(ethylamino)ethanol
CID 170923531
2-(ethylamino)ethanol;hydrate
CID 174456532
2-(ethylamino)ethanol;hydroxylamine
CID 159506848
ethane;2-[2-(ethylamino)ethylamino]ethanol
CID 156647808
2-(dimethylamino)ethanol;ethanol;zirconium
CID 154069577
2-[3-(dimethylamino)propylamino]ethanol;dihydrochloride
CID 21254466
CID 161066727
CID 161066727
copper;bis(2-(dimethylamino)ethanol)
CID 58904293
2-[ethyl(2-hydroxyethyl)amino]ethanol;2-(2-hydroxyethylamino)ethanol
CID 159800308
carbamodithioic acid;2-(ethylamino)ethanol
CID 174237242
2-[2-[hydroxy(methyl)amino]ethylamino]ethanol
CID 142832641
2-(dimethylamino)ethanol;2-(methylamino)ethanol;oxirane
CID 54171414

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)ethanol;2-(ethylamino)ethanol?
The IUPAC name of 2-(dimethylamino)ethanol;2-(ethylamino)ethanol (CID 88639908) is 2-(dimethylamino)ethanol;2-(ethylamino)ethanol.
What is the SMILES notation for 2-(dimethylamino)ethanol;2-(ethylamino)ethanol?
The canonical SMILES for 2-(dimethylamino)ethanol;2-(ethylamino)ethanol is CCNCCO.CN(C)CCO.
What is the InChIKey of 2-(dimethylamino)ethanol;2-(ethylamino)ethanol?
The InChIKey is RJAVNRLDHJKLDN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H11NO/c1-5(2)3-4-6;1-2-5-3-4-6/h6H,3-4H2,1-2H3;5-6H,2-4H2,1H3.
What are the key properties of 2-(dimethylamino)ethanol;2-(ethylamino)ethanol?
2-(dimethylamino)ethanol;2-(ethylamino)ethanol has a molecular weight of 178.28 g/mol, XLogP of -0.87, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)ethanol;2-(ethylamino)ethanol is sourced from PubChem (CID 88639908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).