5-tert-butyl-1-(2-methoxyethyl)imidazole

C10H18N2O — CID 155642185

IUPAC5-tert-butyl-1-(2-methoxyethyl)imidazole
SMILESCOCCn1cncc1C(C)(C)C
InChIInChI=1S/C10H18N2O/c1-10(2,3)9-7-11-8-12(9)5-6-13-4/h7-8H,5-6H2,1-4H3
InChIKeyXBMZVBDUJCWGHX-UHFFFAOYSA-N
MW182.27 g/mol
LogP1.83
Rot. Bonds3

About 5-tert-butyl-1-(2-methoxyethyl)imidazole

5-tert-butyl-1-(2-methoxyethyl)imidazole (PubChem CID 155642185) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 5-tert-butyl-1-(2-methoxyethyl)imidazole.

Molecular Properties

Compound Name5-tert-butyl-1-(2-methoxyethyl)imidazole
PubChem CID155642185
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name5-tert-butyl-1-(2-methoxyethyl)imidazole
SMILESCOCCn1cncc1C(C)(C)C
InChIInChI=1S/C10H18N2O/c1-10(2,3)9-7-11-8-12(9)5-6-13-4/h7-8H,5-6H2,1-4H3
InChIKeyXBMZVBDUJCWGHX-UHFFFAOYSA-N
XLogP1.83
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-1-(2-methoxyethyl)imidazole?
The IUPAC name of 5-tert-butyl-1-(2-methoxyethyl)imidazole (CID 155642185) is 5-tert-butyl-1-(2-methoxyethyl)imidazole.
What is the SMILES notation for 5-tert-butyl-1-(2-methoxyethyl)imidazole?
The canonical SMILES for 5-tert-butyl-1-(2-methoxyethyl)imidazole is COCCn1cncc1C(C)(C)C.
What is the InChIKey of 5-tert-butyl-1-(2-methoxyethyl)imidazole?
The InChIKey is XBMZVBDUJCWGHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-10(2,3)9-7-11-8-12(9)5-6-13-4/h7-8H,5-6H2,1-4H3.
What are the key properties of 5-tert-butyl-1-(2-methoxyethyl)imidazole?
5-tert-butyl-1-(2-methoxyethyl)imidazole has a molecular weight of 182.27 g/mol, XLogP of 1.83, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-1-(2-methoxyethyl)imidazole is sourced from PubChem (CID 155642185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).