2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol

C7H14N2O — CID 66763798

IUPAC2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol
SMILESCC1N(C)C=CN1CCO
InChIInChI=1S/C7H14N2O/c1-7-8(2)3-4-9(7)5-6-10/h3-4,7,10H,5-6H2,1-2H3
InChIKeyMRDOAIDBJHWMTC-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.04
Rot. Bonds2

About 2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol

2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol (PubChem CID 66763798) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol.

Molecular Properties

Compound Name2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol
PubChem CID66763798
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol
SMILESCC1N(C)C=CN1CCO
InChIInChI=1S/C7H14N2O/c1-7-8(2)3-4-9(7)5-6-10/h3-4,7,10H,5-6H2,1-2H3
InChIKeyMRDOAIDBJHWMTC-UHFFFAOYSA-N
XLogP0.04
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol?
The IUPAC name of 2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol (CID 66763798) is 2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol.
What is the SMILES notation for 2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol?
The canonical SMILES for 2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol is CC1N(C)C=CN1CCO.
What is the InChIKey of 2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol?
The InChIKey is MRDOAIDBJHWMTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-7-8(2)3-4-9(7)5-6-10/h3-4,7,10H,5-6H2,1-2H3.
What are the key properties of 2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol?
2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol has a molecular weight of 142.20 g/mol, XLogP of 0.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol is sourced from PubChem (CID 66763798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).