3,4,5-trimethyl-2-methylidene-1H-imidazole

C7H12N2 — CID 54255425

IUPAC3,4,5-trimethyl-2-methylidene-1H-imidazole
SMILESC=C1NC(C)=C(C)N1C
InChIInChI=1S/C7H12N2/c1-5-6(2)9(4)7(3)8-5/h8H,3H2,1-2,4H3
InChIKeyQZRUXDHLWAAVPA-UHFFFAOYSA-N
MW124.19 g/mol
LogP1.24
Rot. Bonds

About 3,4,5-trimethyl-2-methylidene-1H-imidazole

3,4,5-trimethyl-2-methylidene-1H-imidazole (PubChem CID 54255425) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 3,4,5-trimethyl-2-methylidene-1H-imidazole.

Molecular Properties

Compound Name3,4,5-trimethyl-2-methylidene-1H-imidazole
PubChem CID54255425
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name3,4,5-trimethyl-2-methylidene-1H-imidazole
SMILESC=C1NC(C)=C(C)N1C
InChIInChI=1S/C7H12N2/c1-5-6(2)9(4)7(3)8-5/h8H,3H2,1-2,4H3
InChIKeyQZRUXDHLWAAVPA-UHFFFAOYSA-N
XLogP1.24
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4,5-trimethyl-2-methylidene-1H-imidazole?
The IUPAC name of 3,4,5-trimethyl-2-methylidene-1H-imidazole (CID 54255425) is 3,4,5-trimethyl-2-methylidene-1H-imidazole.
What is the SMILES notation for 3,4,5-trimethyl-2-methylidene-1H-imidazole?
The canonical SMILES for 3,4,5-trimethyl-2-methylidene-1H-imidazole is C=C1NC(C)=C(C)N1C.
What is the InChIKey of 3,4,5-trimethyl-2-methylidene-1H-imidazole?
The InChIKey is QZRUXDHLWAAVPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-5-6(2)9(4)7(3)8-5/h8H,3H2,1-2,4H3.
What are the key properties of 3,4,5-trimethyl-2-methylidene-1H-imidazole?
3,4,5-trimethyl-2-methylidene-1H-imidazole has a molecular weight of 124.19 g/mol, XLogP of 1.24, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5-trimethyl-2-methylidene-1H-imidazole is sourced from PubChem (CID 54255425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).