(4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole

C8H12N2 — CID 168727601

IUPAC(4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole
SMILESC=c1/c(=C/C)nc(C)n1C
InChIInChI=1S/C8H12N2/c1-5-8-6(2)10(4)7(3)9-8/h5H,2H2,1,3-4H3/b8-5-
InChIKeyGFUNSNSQLKTRBX-YVMONPNESA-N
MW136.20 g/mol
LogP-0.06
Rot. Bonds

About (4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole

(4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole (PubChem CID 168727601) has the molecular formula C8H12N2 and a molecular weight of 136.20 g/mol. Its IUPAC name is (4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole.

Molecular Properties

Compound Name(4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole
PubChem CID168727601
Molecular FormulaC8H12N2
Molecular Weight136.20 g/mol
Exact Mass136.10
IUPAC Name(4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole
SMILESC=c1/c(=C/C)nc(C)n1C
InChIInChI=1S/C8H12N2/c1-5-8-6(2)10(4)7(3)9-8/h5H,2H2,1,3-4H3/b8-5-
InChIKeyGFUNSNSQLKTRBX-YVMONPNESA-N
XLogP-0.06
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.20
LogP ≤ 5-0.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole?
The IUPAC name of (4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole (CID 168727601) is (4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole.
What is the SMILES notation for (4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole?
The canonical SMILES for (4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole is C=c1/c(=C/C)nc(C)n1C.
What is the InChIKey of (4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole?
The InChIKey is GFUNSNSQLKTRBX-YVMONPNESA-N. The full InChI is InChI=1S/C8H12N2/c1-5-8-6(2)10(4)7(3)9-8/h5H,2H2,1,3-4H3/b8-5-.
What are the key properties of (4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole?
(4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole has a molecular weight of 136.20 g/mol, XLogP of -0.06, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-ethylidene-1,2-dimethyl-5-methylideneimidazole is sourced from PubChem (CID 168727601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).