2-methoxy-3-methylimidazol-4-ol

C5H8N2O2 — CID 126670942

IUPAC2-methoxy-3-methylimidazol-4-ol
SMILESCOc1ncc(O)n1C
InChIInChI=1S/C5H8N2O2/c1-7-4(8)3-6-5(7)9-2/h3,8H,1-2H3
InChIKeyQOYSJIILJPMDHP-UHFFFAOYSA-N
MW128.13 g/mol
LogP0.13
Rot. Bonds1

About 2-methoxy-3-methylimidazol-4-ol

2-methoxy-3-methylimidazol-4-ol (PubChem CID 126670942) has the molecular formula C5H8N2O2 and a molecular weight of 128.13 g/mol. Its IUPAC name is 2-methoxy-3-methylimidazol-4-ol.

Molecular Properties

Compound Name2-methoxy-3-methylimidazol-4-ol
PubChem CID126670942
Molecular FormulaC5H8N2O2
Molecular Weight128.13 g/mol
Exact Mass128.06
IUPAC Name2-methoxy-3-methylimidazol-4-ol
SMILESCOc1ncc(O)n1C
InChIInChI=1S/C5H8N2O2/c1-7-4(8)3-6-5(7)9-2/h3,8H,1-2H3
InChIKeyQOYSJIILJPMDHP-UHFFFAOYSA-N
XLogP0.13
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.13
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-3-methylimidazol-4-ol?
The IUPAC name of 2-methoxy-3-methylimidazol-4-ol (CID 126670942) is 2-methoxy-3-methylimidazol-4-ol.
What is the SMILES notation for 2-methoxy-3-methylimidazol-4-ol?
The canonical SMILES for 2-methoxy-3-methylimidazol-4-ol is COc1ncc(O)n1C.
What is the InChIKey of 2-methoxy-3-methylimidazol-4-ol?
The InChIKey is QOYSJIILJPMDHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O2/c1-7-4(8)3-6-5(7)9-2/h3,8H,1-2H3.
What are the key properties of 2-methoxy-3-methylimidazol-4-ol?
2-methoxy-3-methylimidazol-4-ol has a molecular weight of 128.13 g/mol, XLogP of 0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-methylimidazol-4-ol is sourced from PubChem (CID 126670942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).