1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole

C10H18N4 — CID 67701861

IUPAC1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole
SMILESC=CN1CCN=C1C.CC1=NCCN1
InChIInChI=1S/C6H10N2.C4H8N2/c1-3-8-5-4-7-6(8)2;1-4-5-2-3-6-4/h3H,1,4-5H2,2H3;2-3H2,1H3,(H,5,6)
InChIKeyFKZMBDKTVGDRIV-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.87
Rot. Bonds1

About 1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole

1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole (PubChem CID 67701861) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole
PubChem CID67701861
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole
SMILESC=CN1CCN=C1C.CC1=NCCN1
InChIInChI=1S/C6H10N2.C4H8N2/c1-3-8-5-4-7-6(8)2;1-4-5-2-3-6-4/h3H,1,4-5H2,2H3;2-3H2,1H3,(H,5,6)
InChIKeyFKZMBDKTVGDRIV-UHFFFAOYSA-N
XLogP0.87
TPSA39.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole?
The IUPAC name of 1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole (CID 67701861) is 1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole?
The canonical SMILES for 1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole is C=CN1CCN=C1C.CC1=NCCN1.
What is the InChIKey of 1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole?
The InChIKey is FKZMBDKTVGDRIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2.C4H8N2/c1-3-8-5-4-7-6(8)2;1-4-5-2-3-6-4/h3H,1,4-5H2,2H3;2-3H2,1H3,(H,5,6).
What are the key properties of 1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole?
1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole has a molecular weight of 194.28 g/mol, XLogP of 0.87, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-2-methyl-4,5-dihydroimidazole;2-methyl-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 67701861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).