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

C7H10N2 — CID 123822050

IUPAC(4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole
SMILESC=c1[nH]c(C)n/c1=C/C
InChIInChI=1S/C7H10N2/c1-4-7-5(2)8-6(3)9-7/h4H,2H2,1,3H3,(H,8,9)/b7-4+
InChIKeyIZVKSYLBQRBZBZ-QPJJXVBHSA-N
MW122.17 g/mol
LogP-0.07
Rot. Bonds

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

(4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole (PubChem CID 123822050) has the molecular formula C7H10N2 and a molecular weight of 122.17 g/mol. Its IUPAC name is (4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole.

Molecular Properties

Compound Name(4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole
PubChem CID123822050
Molecular FormulaC7H10N2
Molecular Weight122.17 g/mol
Exact Mass122.08
IUPAC Name(4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole
SMILESC=c1[nH]c(C)n/c1=C/C
InChIInChI=1S/C7H10N2/c1-4-7-5(2)8-6(3)9-7/h4H,2H2,1,3H3,(H,8,9)/b7-4+
InChIKeyIZVKSYLBQRBZBZ-QPJJXVBHSA-N
XLogP-0.07
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 5-0.07
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
(4Z,5E)-4-(1-fluoroethylidene)-2-methyl-5-propylidene-1H-imidazole
CID 145020415
2-Methyl-1,5-dihydrocyclopenta[d]imidazole
CID 23558742
2-Methyl-5-methylidene-1,4-dihydroimidazole
CID 58059446
2-Methyl-1,7-dihydrobenzimidazol-7-ide;yttrium
CID 59098032
4,5-dimethanidylidene-2-methyl-1H-imidazole;yttrium
CID 59908996
2-methyl-4,5-dimethylidene-1H-imidazole
CID 59908997
(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-ethyl-4,5-dimethylidene-1H-imidazole
CID 91247008
(4E,5E)-4-but-2-enylidene-2-ethyl-5-prop-2-enylidene-1H-imidazole
CID 91464077

Frequently Asked Questions

What is the IUPAC name of (4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole?
The IUPAC name of (4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole (CID 123822050) is (4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole.
What is the SMILES notation for (4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole?
The canonical SMILES for (4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole is C=c1[nH]c(C)n/c1=C/C.
What is the InChIKey of (4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole?
The InChIKey is IZVKSYLBQRBZBZ-QPJJXVBHSA-N. The full InChI is InChI=1S/C7H10N2/c1-4-7-5(2)8-6(3)9-7/h4H,2H2,1,3H3,(H,8,9)/b7-4+.
What are the key properties of (4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole?
(4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole has a molecular weight of 122.17 g/mol, XLogP of -0.07, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole is sourced from PubChem (CID 123822050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).