5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole

C11H20N2O — CID 155261577

IUPAC5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole
SMILESCOCCn1cncc1CC(C)(C)C
InChIInChI=1S/C11H20N2O/c1-11(2,3)7-10-8-12-9-13(10)5-6-14-4/h8-9H,5-7H2,1-4H3
InChIKeyCGRXENRYUZBNSY-UHFFFAOYSA-N
MW196.29 g/mol
LogP2.12
Rot. Bonds4

About 5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole

5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole (PubChem CID 155261577) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole.

Molecular Properties

Compound Name5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole
PubChem CID155261577
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole
SMILESCOCCn1cncc1CC(C)(C)C
InChIInChI=1S/C11H20N2O/c1-11(2,3)7-10-8-12-9-13(10)5-6-14-4/h8-9H,5-7H2,1-4H3
InChIKeyCGRXENRYUZBNSY-UHFFFAOYSA-N
XLogP2.12
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
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 5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole?
The IUPAC name of 5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole (CID 155261577) is 5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole.
What is the SMILES notation for 5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole?
The canonical SMILES for 5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole is COCCn1cncc1CC(C)(C)C.
What is the InChIKey of 5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole?
The InChIKey is CGRXENRYUZBNSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-11(2,3)7-10-8-12-9-13(10)5-6-14-4/h8-9H,5-7H2,1-4H3.
What are the key properties of 5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole?
5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole has a molecular weight of 196.29 g/mol, XLogP of 2.12, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,2-dimethylpropyl)-1-(2-methoxyethyl)imidazole is sourced from PubChem (CID 155261577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).