(4,5-dimethyl-1H-imidazol-2-yl)methanol

C6H10N2O — CID 46784770

IUPAC(4,5-dimethyl-1H-imidazol-2-yl)methanol
SMILESCc1nc(CO)[nH]c1C
InChIInChI=1S/C6H10N2O/c1-4-5(2)8-6(3-9)7-4/h9H,3H2,1-2H3,(H,7,8)
InChIKeyXRUICZARPZYJTK-UHFFFAOYSA-N
MW126.16 g/mol
LogP0.52
Rot. Bonds1

About (4,5-dimethyl-1H-imidazol-2-yl)methanol

(4,5-dimethyl-1H-imidazol-2-yl)methanol (PubChem CID 46784770) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is (4,5-dimethyl-1H-imidazol-2-yl)methanol.

Molecular Properties

Compound Name(4,5-dimethyl-1H-imidazol-2-yl)methanol
PubChem CID46784770
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name(4,5-dimethyl-1H-imidazol-2-yl)methanol
SMILESCc1nc(CO)[nH]c1C
InChIInChI=1S/C6H10N2O/c1-4-5(2)8-6(3-9)7-4/h9H,3H2,1-2H3,(H,7,8)
InChIKeyXRUICZARPZYJTK-UHFFFAOYSA-N
XLogP0.52
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4,5-dimethyl-1H-imidazol-2-yl)methanol?
The IUPAC name of (4,5-dimethyl-1H-imidazol-2-yl)methanol (CID 46784770) is (4,5-dimethyl-1H-imidazol-2-yl)methanol.
What is the SMILES notation for (4,5-dimethyl-1H-imidazol-2-yl)methanol?
The canonical SMILES for (4,5-dimethyl-1H-imidazol-2-yl)methanol is Cc1nc(CO)[nH]c1C.
What is the InChIKey of (4,5-dimethyl-1H-imidazol-2-yl)methanol?
The InChIKey is XRUICZARPZYJTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-4-5(2)8-6(3-9)7-4/h9H,3H2,1-2H3,(H,7,8).
What are the key properties of (4,5-dimethyl-1H-imidazol-2-yl)methanol?
(4,5-dimethyl-1H-imidazol-2-yl)methanol has a molecular weight of 126.16 g/mol, XLogP of 0.52, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4,5-dimethyl-1H-imidazol-2-yl)methanol is sourced from PubChem (CID 46784770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).