(5E)-5-ethylidene-1,2,4,4-tetramethylimidazole

C9H16N2 — CID 137427466

IUPAC(5E)-5-ethylidene-1,2,4,4-tetramethylimidazole
SMILESC/C=C1/N(C)C(C)=NC1(C)C
InChIInChI=1S/C9H16N2/c1-6-8-9(3,4)10-7(2)11(8)5/h6H,1-5H3/b8-6+
InChIKeyVIKMAASHHYRZNM-SOFGYWHQSA-N
MW152.24 g/mol
LogP2.03
Rot. Bonds

About (5E)-5-ethylidene-1,2,4,4-tetramethylimidazole

(5E)-5-ethylidene-1,2,4,4-tetramethylimidazole (PubChem CID 137427466) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is (5E)-5-ethylidene-1,2,4,4-tetramethylimidazole.

Molecular Properties

Compound Name(5E)-5-ethylidene-1,2,4,4-tetramethylimidazole
PubChem CID137427466
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name(5E)-5-ethylidene-1,2,4,4-tetramethylimidazole
SMILESC/C=C1/N(C)C(C)=NC1(C)C
InChIInChI=1S/C9H16N2/c1-6-8-9(3,4)10-7(2)11(8)5/h6H,1-5H3/b8-6+
InChIKeyVIKMAASHHYRZNM-SOFGYWHQSA-N
XLogP2.03
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5E)-5-ethylidene-1,2,4,4-tetramethylimidazole?
The IUPAC name of (5E)-5-ethylidene-1,2,4,4-tetramethylimidazole (CID 137427466) is (5E)-5-ethylidene-1,2,4,4-tetramethylimidazole.
What is the SMILES notation for (5E)-5-ethylidene-1,2,4,4-tetramethylimidazole?
The canonical SMILES for (5E)-5-ethylidene-1,2,4,4-tetramethylimidazole is C/C=C1/N(C)C(C)=NC1(C)C.
What is the InChIKey of (5E)-5-ethylidene-1,2,4,4-tetramethylimidazole?
The InChIKey is VIKMAASHHYRZNM-SOFGYWHQSA-N. The full InChI is InChI=1S/C9H16N2/c1-6-8-9(3,4)10-7(2)11(8)5/h6H,1-5H3/b8-6+.
What are the key properties of (5E)-5-ethylidene-1,2,4,4-tetramethylimidazole?
(5E)-5-ethylidene-1,2,4,4-tetramethylimidazole has a molecular weight of 152.24 g/mol, XLogP of 2.03, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-ethylidene-1,2,4,4-tetramethylimidazole is sourced from PubChem (CID 137427466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).