1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole

C12H22N2O — CID 167352872

IUPAC1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole
SMILESCOCCn1c(C(C)C)cnc1C(C)C
InChIInChI=1S/C12H22N2O/c1-9(2)11-8-13-12(10(3)4)14(11)6-7-15-5/h8-10H,6-7H2,1-5H3
InChIKeyUFSHRGHPBOBFIY-UHFFFAOYSA-N
MW210.32 g/mol
LogP2.78
Rot. Bonds5

About 1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole

1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole (PubChem CID 167352872) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole.

Molecular Properties

Compound Name1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole
PubChem CID167352872
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole
SMILESCOCCn1c(C(C)C)cnc1C(C)C
InChIInChI=1S/C12H22N2O/c1-9(2)11-8-13-12(10(3)4)14(11)6-7-15-5/h8-10H,6-7H2,1-5H3
InChIKeyUFSHRGHPBOBFIY-UHFFFAOYSA-N
XLogP2.78
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole?
The IUPAC name of 1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole (CID 167352872) is 1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole.
What is the SMILES notation for 1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole?
The canonical SMILES for 1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole is COCCn1c(C(C)C)cnc1C(C)C.
What is the InChIKey of 1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole?
The InChIKey is UFSHRGHPBOBFIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-9(2)11-8-13-12(10(3)4)14(11)6-7-15-5/h8-10H,6-7H2,1-5H3.
What are the key properties of 1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole?
1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole has a molecular weight of 210.32 g/mol, XLogP of 2.78, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-2,5-di(propan-2-yl)imidazole is sourced from PubChem (CID 167352872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).