2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride

C8H18Cl2N2O — CID 66718047

IUPAC2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride
SMILESCC(C)C1=NCC(CCO)N1.Cl.Cl
InChIInChI=1S/C8H16N2O.2ClH/c1-6(2)8-9-5-7(10-8)3-4-11;;/h6-7,11H,3-5H2,1-2H3,(H,9,10);2*1H
InChIKeyJLZGZDPNPWICGW-UHFFFAOYSA-N
MW229.15 g/mol
LogP1.24
Rot. Bonds3

About 2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride

2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride (PubChem CID 66718047) has the molecular formula C8H18Cl2N2O and a molecular weight of 229.15 g/mol. Its IUPAC name is 2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride.

Molecular Properties

Compound Name2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride
PubChem CID66718047
Molecular FormulaC8H18Cl2N2O
Molecular Weight229.15 g/mol
Exact Mass228.08
IUPAC Name2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride
SMILESCC(C)C1=NCC(CCO)N1.Cl.Cl
InChIInChI=1S/C8H16N2O.2ClH/c1-6(2)8-9-5-7(10-8)3-4-11;;/h6-7,11H,3-5H2,1-2H3,(H,9,10);2*1H
InChIKeyJLZGZDPNPWICGW-UHFFFAOYSA-N
XLogP1.24
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.15
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride?
The IUPAC name of 2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride (CID 66718047) is 2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride.
What is the SMILES notation for 2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride?
The canonical SMILES for 2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride is CC(C)C1=NCC(CCO)N1.Cl.Cl.
What is the InChIKey of 2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride?
The InChIKey is JLZGZDPNPWICGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O.2ClH/c1-6(2)8-9-5-7(10-8)3-4-11;;/h6-7,11H,3-5H2,1-2H3,(H,9,10);2*1H.
What are the key properties of 2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride?
2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride has a molecular weight of 229.15 g/mol, XLogP of 1.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride is sourced from PubChem (CID 66718047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).