2-methyl-4,5-dimethylidene-1H-imidazole

C6H8N2 — CID 59908997

IUPAC2-methyl-4,5-dimethylidene-1H-imidazole
SMILESC=c1nc(C)[nH]c1=C
InChIInChI=1S/C6H8N2/c1-4-5(2)8-6(3)7-4/h1-2H2,3H3,(H,7,8)
InChIKeyRHRKADRRJAZWRG-UHFFFAOYSA-N
MW108.14 g/mol
LogP-0.46
Rot. Bonds

About 2-methyl-4,5-dimethylidene-1H-imidazole

2-methyl-4,5-dimethylidene-1H-imidazole (PubChem CID 59908997) has the molecular formula C6H8N2 and a molecular weight of 108.14 g/mol. Its IUPAC name is 2-methyl-4,5-dimethylidene-1H-imidazole.

Molecular Properties

Compound Name2-methyl-4,5-dimethylidene-1H-imidazole
PubChem CID59908997
Molecular FormulaC6H8N2
Molecular Weight108.14 g/mol
Exact Mass108.07
IUPAC Name2-methyl-4,5-dimethylidene-1H-imidazole
SMILESC=c1nc(C)[nH]c1=C
InChIInChI=1S/C6H8N2/c1-4-5(2)8-6(3)7-4/h1-2H2,3H3,(H,7,8)
InChIKeyRHRKADRRJAZWRG-UHFFFAOYSA-N
XLogP-0.46
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.14
LogP ≤ 5-0.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(4E,5E)-4,5-bis(2-fluoroethylidene)-2-methyl-1H-imidazole
CID 132003996
2-Methyl-5-methylidene-1,4-dihydroimidazole
CID 58059446
4,5-dimethanidylidene-2-methyl-1H-imidazole;yttrium
CID 59908996
N'-[(E)-(2-methyl-5-methylidene-1H-imidazol-4-ylidene)methyl]methanediamine
CID 88918609
2-ethyl-4,5-dimethylidene-1H-imidazole
CID 91247008
(4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1H-imidazole
CID 123195019
(4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole
CID 123822050
(4E,5E)-4,5-di(ethylidene)-2-methyl-1H-imidazole
CID 132261721
(4E)-4-[(Z)-but-2-enylidene]-2-methyl-5-methylidene-1H-imidazole
CID 138600509
(E)-[(4E)-4-(aminomethylidene)-2-methyl-1H-imidazol-5-ylidene]methanamine
CID 139297378
(4E)-4-[(Z)-but-2-enylidene]-2-methyl-5-methylidene-1H-imidazole;ethane
CID 141897496
(4E)-4-[(Z)-but-2-enylidene]-2-methyl-5-methylidene-1H-imidazole;ethane
CID 141954953

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4,5-dimethylidene-1H-imidazole?
The IUPAC name of 2-methyl-4,5-dimethylidene-1H-imidazole (CID 59908997) is 2-methyl-4,5-dimethylidene-1H-imidazole.
What is the SMILES notation for 2-methyl-4,5-dimethylidene-1H-imidazole?
The canonical SMILES for 2-methyl-4,5-dimethylidene-1H-imidazole is C=c1nc(C)[nH]c1=C.
What is the InChIKey of 2-methyl-4,5-dimethylidene-1H-imidazole?
The InChIKey is RHRKADRRJAZWRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2/c1-4-5(2)8-6(3)7-4/h1-2H2,3H3,(H,7,8).
What are the key properties of 2-methyl-4,5-dimethylidene-1H-imidazole?
2-methyl-4,5-dimethylidene-1H-imidazole has a molecular weight of 108.14 g/mol, XLogP of -0.46, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4,5-dimethylidene-1H-imidazole is sourced from PubChem (CID 59908997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).