1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole

C10H12N4 — CID 54280679

IUPAC1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole
SMILESCn1ccnc1C=Cc1nccn1C
InChIInChI=1S/C10H12N4/c1-13-7-5-11-9(13)3-4-10-12-6-8-14(10)2/h3-8H,1-2H3
InChIKeyRQOHLMSVFYFMRT-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.32
Rot. Bonds2

About 1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole

1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole (PubChem CID 54280679) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole.

Molecular Properties

Compound Name1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole
PubChem CID54280679
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole
SMILESCn1ccnc1C=Cc1nccn1C
InChIInChI=1S/C10H12N4/c1-13-7-5-11-9(13)3-4-10-12-6-8-14(10)2/h3-8H,1-2H3
InChIKeyRQOHLMSVFYFMRT-UHFFFAOYSA-N
XLogP1.32
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1,2-Dimethyl-3-propylimidazolium Iodide
CID 11459786
1-Butyl-2-methyl-1H-imidazole
CID 304622
2-methylimidazole zinc salt
CID 15245636
1-Allyl-3-methylimidazolium chloride
CID 11321106
1-methyl-2-[(E)-2-(1-methylimidazol-2-yl)ethenyl]-5-nitroimidazole
CID 44186536
1,1'-Carbonylbis(2-methylimidazole)
CID 719806
N-(dimethylallyl)imidazole
CID 57339814
(1E,4E)-1,5-bis(1-methylimidazol-2-yl)penta-1,4-dien-3-one
CID 76311140
(1E,4E)-1,5-bis(1-ethylimidazol-2-yl)penta-1,4-dien-3-one
CID 122177386
1-(1-Imidazol-1-yl-1-methyl-ethyl)imidazole
CID 3007429
1,1'-(1,4-Butanediyl)bis(imidazole)
CID 5251826
1-Allyl-3-methylimidazolium bromide
CID 11229454

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole?
The IUPAC name of 1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole (CID 54280679) is 1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole.
What is the SMILES notation for 1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole?
The canonical SMILES for 1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole is Cn1ccnc1C=Cc1nccn1C.
What is the InChIKey of 1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole?
The InChIKey is RQOHLMSVFYFMRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-13-7-5-11-9(13)3-4-10-12-6-8-14(10)2/h3-8H,1-2H3.
What are the key properties of 1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole?
1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole has a molecular weight of 188.23 g/mol, XLogP of 1.32, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[2-(1-methylimidazol-2-yl)ethenyl]imidazole is sourced from PubChem (CID 54280679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).