4-(2-methoxyethyl)-5-methyl-1H-imidazole

C7H12N2O — CID 173053461

IUPAC4-(2-methoxyethyl)-5-methyl-1H-imidazole
SMILESCOCCc1nc[nH]c1C
InChIInChI=1S/C7H12N2O/c1-6-7(3-4-10-2)9-5-8-6/h5H,3-4H2,1-2H3,(H,8,9)
InChIKeyIJOUBFXCUUNEES-UHFFFAOYSA-N
MW140.19 g/mol
LogP0.91
Rot. Bonds3

About 4-(2-methoxyethyl)-5-methyl-1H-imidazole

4-(2-methoxyethyl)-5-methyl-1H-imidazole (PubChem CID 173053461) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 4-(2-methoxyethyl)-5-methyl-1H-imidazole.

Molecular Properties

Compound Name4-(2-methoxyethyl)-5-methyl-1H-imidazole
PubChem CID173053461
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name4-(2-methoxyethyl)-5-methyl-1H-imidazole
SMILESCOCCc1nc[nH]c1C
InChIInChI=1S/C7H12N2O/c1-6-7(3-4-10-2)9-5-8-6/h5H,3-4H2,1-2H3,(H,8,9)
InChIKeyIJOUBFXCUUNEES-UHFFFAOYSA-N
XLogP0.91
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyethyl)-5-methyl-1H-imidazole?
The IUPAC name of 4-(2-methoxyethyl)-5-methyl-1H-imidazole (CID 173053461) is 4-(2-methoxyethyl)-5-methyl-1H-imidazole.
What is the SMILES notation for 4-(2-methoxyethyl)-5-methyl-1H-imidazole?
The canonical SMILES for 4-(2-methoxyethyl)-5-methyl-1H-imidazole is COCCc1nc[nH]c1C.
What is the InChIKey of 4-(2-methoxyethyl)-5-methyl-1H-imidazole?
The InChIKey is IJOUBFXCUUNEES-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-6-7(3-4-10-2)9-5-8-6/h5H,3-4H2,1-2H3,(H,8,9).
What are the key properties of 4-(2-methoxyethyl)-5-methyl-1H-imidazole?
4-(2-methoxyethyl)-5-methyl-1H-imidazole has a molecular weight of 140.19 g/mol, XLogP of 0.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethyl)-5-methyl-1H-imidazole is sourced from PubChem (CID 173053461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).