(4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole

C8H10N2 — CID 142058909

IUPAC(4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole
SMILESC=C/C=c1/nc(C)[nH]c1=C
InChIInChI=1S/C8H10N2/c1-4-5-8-6(2)9-7(3)10-8/h4-5H,1-2H2,3H3,(H,9,10)/b8-5+
InChIKeyIODYRHLKTUBEFD-VMPITWQZSA-N
MW134.18 g/mol
LogP0.09
Rot. Bonds1

About (4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole

(4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole (PubChem CID 142058909) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is (4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole.

Molecular Properties

Compound Name(4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole
PubChem CID142058909
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name(4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole
SMILESC=C/C=c1/nc(C)[nH]c1=C
InChIInChI=1S/C8H10N2/c1-4-5-8-6(2)9-7(3)10-8/h4-5H,1-2H2,3H3,(H,9,10)/b8-5+
InChIKeyIODYRHLKTUBEFD-VMPITWQZSA-N
XLogP0.09
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 50.09
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-1,7-dihydrobenzimidazol-7-ide;yttrium
CID 59098032
2-methyl-4,5-dimethylidene-1H-imidazole
CID 59908997
(5Z,7Z)-2-methyl-9-methylidene-1,4-dihydro-1,3-diazonine
CID 68220253
(E)-[(4E)-2-methyl-4-prop-2-enylidene-1H-imidazol-5-ylidene]methanamine
CID 88586966
[(4E,5E)-4-ethylidene-5-prop-2-enylidene-1H-imidazol-2-yl]methanamine
CID 88939569
2,4-dimethyl-6-methylidene-1H-pyrimidine
CID 89182777
2-[(4E)-5-methylidene-4-prop-2-enylidene-1H-imidazol-2-yl]acetonitrile
CID 89341327
(4E,5E)-4-but-2-enylidene-2-ethyl-5-prop-2-enylidene-1H-imidazole
CID 91464077
N'-ethyl-N-[(3Z)-hexa-1,3,5-trien-2-yl]ethanimidamide
CID 121279957
(4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1H-imidazole
CID 123195019
[(4E)-4-but-2-enylidene-5-methylidene-1H-imidazol-2-yl]methanamine
CID 123452172

Frequently Asked Questions

What is the IUPAC name of (4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole?
The IUPAC name of (4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole (CID 142058909) is (4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole.
What is the SMILES notation for (4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole?
The canonical SMILES for (4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole is C=C/C=c1/nc(C)[nH]c1=C.
What is the InChIKey of (4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole?
The InChIKey is IODYRHLKTUBEFD-VMPITWQZSA-N. The full InChI is InChI=1S/C8H10N2/c1-4-5-8-6(2)9-7(3)10-8/h4-5H,1-2H2,3H3,(H,9,10)/b8-5+.
What are the key properties of (4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole?
(4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole has a molecular weight of 134.18 g/mol, XLogP of 0.09, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4E)-2-methyl-5-methylidene-4-prop-2-enylidene-1H-imidazole is sourced from PubChem (CID 142058909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).