1-ethyl-5-methyl-2-(oxan-4-yl)imidazole

C11H18N2O — CID 130382152

IUPAC1-ethyl-5-methyl-2-(oxan-4-yl)imidazole
SMILESCCn1c(C)cnc1C1CCOCC1
InChIInChI=1S/C11H18N2O/c1-3-13-9(2)8-12-11(13)10-4-6-14-7-5-10/h8,10H,3-7H2,1-2H3
InChIKeyOVKMYMLLFJOITJ-UHFFFAOYSA-N
MW194.28 g/mol
LogP2.11
Rot. Bonds2

About 1-ethyl-5-methyl-2-(oxan-4-yl)imidazole

1-ethyl-5-methyl-2-(oxan-4-yl)imidazole (PubChem CID 130382152) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-ethyl-5-methyl-2-(oxan-4-yl)imidazole.

Molecular Properties

Compound Name1-ethyl-5-methyl-2-(oxan-4-yl)imidazole
PubChem CID130382152
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name1-ethyl-5-methyl-2-(oxan-4-yl)imidazole
SMILESCCn1c(C)cnc1C1CCOCC1
InChIInChI=1S/C11H18N2O/c1-3-13-9(2)8-12-11(13)10-4-6-14-7-5-10/h8,10H,3-7H2,1-2H3
InChIKeyOVKMYMLLFJOITJ-UHFFFAOYSA-N
XLogP2.11
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-{[1-(3-methoxypropyl)-5-methyl-1H-imidazol-2-yl]methyl}piperidine
CID 86820593
4-(5-methyl-2-tetrahydro-2H-pyran-4-yl-1H-imidazol-1-yl)piperidine
CID 90488060
3-[5-Methyl-2-(oxan-4-YL)-1H-imidazol-1-YL]piperidine
CID 90488101
2-[5-Methyl-2-(oxan-4-YL)-1H-imidazol-1-YL]ethan-1-amine
CID 91911584
4-[[5-methyl-2-(oxan-4-yl)imidazol-1-yl]methyl]-N-propylpiperidine-1-carboxamide
CID 91923574
1-(4-{[1-(2-Methoxyethyl)-5-methyl-1H-imidazol-2-YL]methyl}piperidin-1-YL)ethan-1-one
CID 91923921
N~4~-[2-(1-Isopropyl-5-methyl-1H-imidazol-2-YL)ethyl]tetrahydro-2H-pyran-4-carboxamide
CID 91923972
1-{4-[(2-Cyclopropyl-5-methyl-1H-imidazol-1-YL)methyl]piperidin-1-YL}ethan-1-one
CID 110198102
3-(2,5-Dimethyl-1H-imidazol-1-YL)-1-(oxane-4-carbonyl)piperidine
CID 124046303
1-Cyclopropanecarbonyl-4-{[5-methyl-2-(oxan-4-YL)-1H-imidazol-1-YL]methyl}piperidine
CID 124047014
1-Cycloheptyl-4-{[5-methyl-2-(oxan-4-YL)-1H-imidazol-1-YL]methyl}piperidine
CID 124047030
N,N-Diethyl-4-[5-methyl-2-(oxan-4-YL)-1H-imidazol-1-YL]piperidine-1-carboxamide
CID 124047212

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-methyl-2-(oxan-4-yl)imidazole?
The IUPAC name of 1-ethyl-5-methyl-2-(oxan-4-yl)imidazole (CID 130382152) is 1-ethyl-5-methyl-2-(oxan-4-yl)imidazole.
What is the SMILES notation for 1-ethyl-5-methyl-2-(oxan-4-yl)imidazole?
The canonical SMILES for 1-ethyl-5-methyl-2-(oxan-4-yl)imidazole is CCn1c(C)cnc1C1CCOCC1.
What is the InChIKey of 1-ethyl-5-methyl-2-(oxan-4-yl)imidazole?
The InChIKey is OVKMYMLLFJOITJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-3-13-9(2)8-12-11(13)10-4-6-14-7-5-10/h8,10H,3-7H2,1-2H3.
What are the key properties of 1-ethyl-5-methyl-2-(oxan-4-yl)imidazole?
1-ethyl-5-methyl-2-(oxan-4-yl)imidazole has a molecular weight of 194.28 g/mol, XLogP of 2.11, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-methyl-2-(oxan-4-yl)imidazole is sourced from PubChem (CID 130382152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).