2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole

C11H20N2O — CID 54499010

IUPAC2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole
SMILESCOC(C)Cc1nccn1CC(C)C
InChIInChI=1S/C11H20N2O/c1-9(2)8-13-6-5-12-11(13)7-10(3)14-4/h5-6,9-10H,7-8H2,1-4H3
InChIKeyYBDBONQFAPROGO-UHFFFAOYSA-N
MW196.29 g/mol
LogP2.12
Rot. Bonds5

About 2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole

2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole (PubChem CID 54499010) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole.

Molecular Properties

Compound Name2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole
PubChem CID54499010
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole
SMILESCOC(C)Cc1nccn1CC(C)C
InChIInChI=1S/C11H20N2O/c1-9(2)8-13-6-5-12-11(13)7-10(3)14-4/h5-6,9-10H,7-8H2,1-4H3
InChIKeyYBDBONQFAPROGO-UHFFFAOYSA-N
XLogP2.12
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole?
The IUPAC name of 2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole (CID 54499010) is 2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole.
What is the SMILES notation for 2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole?
The canonical SMILES for 2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole is COC(C)Cc1nccn1CC(C)C.
What is the InChIKey of 2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole?
The InChIKey is YBDBONQFAPROGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-9(2)8-13-6-5-12-11(13)7-10(3)14-4/h5-6,9-10H,7-8H2,1-4H3.
What are the key properties of 2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole?
2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole has a molecular weight of 196.29 g/mol, XLogP of 2.12, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole is sourced from PubChem (CID 54499010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).