5-ethylidene-1-methyl-4-methylideneimidazole

C7H10N2 — CID 123678686

IUPAC5-ethylidene-1-methyl-4-methylideneimidazole
SMILESC=c1ncn(C)c1=CC
InChIInChI=1S/C7H10N2/c1-4-7-6(2)8-5-9(7)3/h4-5H,2H2,1,3H3
InChIKeySLNBAMUMVBJZRG-UHFFFAOYSA-N
MW122.17 g/mol
LogP-0.37
Rot. Bonds

About 5-ethylidene-1-methyl-4-methylideneimidazole

5-ethylidene-1-methyl-4-methylideneimidazole (PubChem CID 123678686) has the molecular formula C7H10N2 and a molecular weight of 122.17 g/mol. Its IUPAC name is 5-ethylidene-1-methyl-4-methylideneimidazole.

Molecular Properties

Compound Name5-ethylidene-1-methyl-4-methylideneimidazole
PubChem CID123678686
Molecular FormulaC7H10N2
Molecular Weight122.17 g/mol
Exact Mass122.08
IUPAC Name5-ethylidene-1-methyl-4-methylideneimidazole
SMILESC=c1ncn(C)c1=CC
InChIInChI=1S/C7H10N2/c1-4-7-6(2)8-5-9(7)3/h4-5H,2H2,1,3H3
InChIKeySLNBAMUMVBJZRG-UHFFFAOYSA-N
XLogP-0.37
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 5-0.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-Ethyl-5-(1-fluoroprop-2-enylidene)-4-methylideneimidazole
CID 124012782
1-[(E)-but-2-en-2-yl]-4,5-dihydroimidazole
CID 23175353
1-But-2-en-2-yl-4,5-dihydroimidazole
CID 67796429
1-methyl-5-methylidene-4H-imidazole
CID 67978393
(4E,5E)-4,5-di(ethylidene)-1H-imidazole
CID 90084299
N-[3-(5-ethylidene-3-methylimidazol-4-ylidene)prop-1-en-2-yl]-N-methylbut-2-en-2-amine
CID 123218601
4-Ethenylidene-1-methyl-5-(3-methylbut-2-enylidene)imidazole
CID 123437116
1,1-Dimethyl-4,5-dimethylideneimidazol-1-ium
CID 123701856
1-Ethyl-4-methylidene-5-prop-2-enylideneimidazole
CID 123739949
1-Methyl-4,5-dimethylideneimidazole
CID 123744878
4-But-3-en-2-ylidene-5-ethylidene-1-methylimidazole
CID 123878865
(4Z,5E)-4-(1-chloroethylidene)-5-(2-chloroprop-2-enylidene)-1-methylimidazole
CID 126495002

Frequently Asked Questions

What is the IUPAC name of 5-ethylidene-1-methyl-4-methylideneimidazole?
The IUPAC name of 5-ethylidene-1-methyl-4-methylideneimidazole (CID 123678686) is 5-ethylidene-1-methyl-4-methylideneimidazole.
What is the SMILES notation for 5-ethylidene-1-methyl-4-methylideneimidazole?
The canonical SMILES for 5-ethylidene-1-methyl-4-methylideneimidazole is C=c1ncn(C)c1=CC.
What is the InChIKey of 5-ethylidene-1-methyl-4-methylideneimidazole?
The InChIKey is SLNBAMUMVBJZRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2/c1-4-7-6(2)8-5-9(7)3/h4-5H,2H2,1,3H3.
What are the key properties of 5-ethylidene-1-methyl-4-methylideneimidazole?
5-ethylidene-1-methyl-4-methylideneimidazole has a molecular weight of 122.17 g/mol, XLogP of -0.37, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethylidene-1-methyl-4-methylideneimidazole is sourced from PubChem (CID 123678686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).