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

C5H8N2 — CID 58059446

IUPAC2-methyl-5-methylidene-1,4-dihydroimidazole
SMILESC=C1CN=C(C)N1
InChIInChI=1S/C5H8N2/c1-4-3-6-5(2)7-4/h1,3H2,2H3,(H,6,7)
InChIKeyLSIRKAYWVUDTPI-UHFFFAOYSA-N
MW96.13 g/mol
LogP0.52
Rot. Bonds

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

2-methyl-5-methylidene-1,4-dihydroimidazole (PubChem CID 58059446) has the molecular formula C5H8N2 and a molecular weight of 96.13 g/mol. Its IUPAC name is 2-methyl-5-methylidene-1,4-dihydroimidazole.

Molecular Properties

Compound Name2-methyl-5-methylidene-1,4-dihydroimidazole
PubChem CID58059446
Molecular FormulaC5H8N2
Molecular Weight96.13 g/mol
Exact Mass96.07
IUPAC Name2-methyl-5-methylidene-1,4-dihydroimidazole
SMILESC=C1CN=C(C)N1
InChIInChI=1S/C5H8N2/c1-4-3-6-5(2)7-4/h1,3H2,2H3,(H,6,7)
InChIKeyLSIRKAYWVUDTPI-UHFFFAOYSA-N
XLogP0.52
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.13
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-methylidene-1,4-dihydroimidazole?
The IUPAC name of 2-methyl-5-methylidene-1,4-dihydroimidazole (CID 58059446) is 2-methyl-5-methylidene-1,4-dihydroimidazole.
What is the SMILES notation for 2-methyl-5-methylidene-1,4-dihydroimidazole?
The canonical SMILES for 2-methyl-5-methylidene-1,4-dihydroimidazole is C=C1CN=C(C)N1.
What is the InChIKey of 2-methyl-5-methylidene-1,4-dihydroimidazole?
The InChIKey is LSIRKAYWVUDTPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2/c1-4-3-6-5(2)7-4/h1,3H2,2H3,(H,6,7).
What are the key properties of 2-methyl-5-methylidene-1,4-dihydroimidazole?
2-methyl-5-methylidene-1,4-dihydroimidazole has a molecular weight of 96.13 g/mol, XLogP of 0.52, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-methylidene-1,4-dihydroimidazole is sourced from PubChem (CID 58059446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).