4-ethoxy-1,3-dimethyl-2H-imidazole

C7H14N2O — CID 174980640

IUPAC4-ethoxy-1,3-dimethyl-2H-imidazole
SMILESCCOC1=CN(C)CN1C
InChIInChI=1S/C7H14N2O/c1-4-10-7-5-8(2)6-9(7)3/h5H,4,6H2,1-3H3
InChIKeyVXDKWFXIYHARBQ-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.66
Rot. Bonds2

About 4-ethoxy-1,3-dimethyl-2H-imidazole

4-ethoxy-1,3-dimethyl-2H-imidazole (PubChem CID 174980640) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 4-ethoxy-1,3-dimethyl-2H-imidazole.

Molecular Properties

Compound Name4-ethoxy-1,3-dimethyl-2H-imidazole
PubChem CID174980640
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name4-ethoxy-1,3-dimethyl-2H-imidazole
SMILESCCOC1=CN(C)CN1C
InChIInChI=1S/C7H14N2O/c1-4-10-7-5-8(2)6-9(7)3/h5H,4,6H2,1-3H3
InChIKeyVXDKWFXIYHARBQ-UHFFFAOYSA-N
XLogP0.66
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-1,3-dimethyl-2H-imidazole?
The IUPAC name of 4-ethoxy-1,3-dimethyl-2H-imidazole (CID 174980640) is 4-ethoxy-1,3-dimethyl-2H-imidazole.
What is the SMILES notation for 4-ethoxy-1,3-dimethyl-2H-imidazole?
The canonical SMILES for 4-ethoxy-1,3-dimethyl-2H-imidazole is CCOC1=CN(C)CN1C.
What is the InChIKey of 4-ethoxy-1,3-dimethyl-2H-imidazole?
The InChIKey is VXDKWFXIYHARBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-4-10-7-5-8(2)6-9(7)3/h5H,4,6H2,1-3H3.
What are the key properties of 4-ethoxy-1,3-dimethyl-2H-imidazole?
4-ethoxy-1,3-dimethyl-2H-imidazole has a molecular weight of 142.20 g/mol, XLogP of 0.66, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-1,3-dimethyl-2H-imidazole is sourced from PubChem (CID 174980640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).