1-ethyl-2-methyl-4,5-dihydroimidazole

C6H12N2 — CID 10996989

IUPAC1-ethyl-2-methyl-4,5-dihydroimidazole
SMILESCCN1CCN=C1C
InChIInChI=1S/C6H12N2/c1-3-8-5-4-7-6(8)2/h3-5H2,1-2H3
InChIKeyVMZNMSUASLBPDS-UHFFFAOYSA-N
MW112.18 g/mol
LogP0.74
Rot. Bonds1

About 1-ethyl-2-methyl-4,5-dihydroimidazole

1-ethyl-2-methyl-4,5-dihydroimidazole (PubChem CID 10996989) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is 1-ethyl-2-methyl-4,5-dihydroimidazole.

Molecular Properties

Compound Name1-ethyl-2-methyl-4,5-dihydroimidazole
PubChem CID10996989
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC Name1-ethyl-2-methyl-4,5-dihydroimidazole
SMILESCCN1CCN=C1C
InChIInChI=1S/C6H12N2/c1-3-8-5-4-7-6(8)2/h3-5H2,1-2H3
InChIKeyVMZNMSUASLBPDS-UHFFFAOYSA-N
XLogP0.74
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-methyl-4,5-dihydroimidazole?
The IUPAC name of 1-ethyl-2-methyl-4,5-dihydroimidazole (CID 10996989) is 1-ethyl-2-methyl-4,5-dihydroimidazole.
What is the SMILES notation for 1-ethyl-2-methyl-4,5-dihydroimidazole?
The canonical SMILES for 1-ethyl-2-methyl-4,5-dihydroimidazole is CCN1CCN=C1C.
What is the InChIKey of 1-ethyl-2-methyl-4,5-dihydroimidazole?
The InChIKey is VMZNMSUASLBPDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2/c1-3-8-5-4-7-6(8)2/h3-5H2,1-2H3.
What are the key properties of 1-ethyl-2-methyl-4,5-dihydroimidazole?
1-ethyl-2-methyl-4,5-dihydroimidazole has a molecular weight of 112.18 g/mol, XLogP of 0.74, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-methyl-4,5-dihydroimidazole is sourced from PubChem (CID 10996989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).