(4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole

C11H18N2 — CID 143526408

IUPAC(4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole
SMILESCC/C=c1/nc(C)n(C)/c1=C/CC
InChIInChI=1S/C11H18N2/c1-5-7-10-11(8-6-2)13(4)9(3)12-10/h7-8H,5-6H2,1-4H3/b10-7+,11-8+
InChIKeyMOORMYUOWGWREQ-AMMQDNIMSA-N
MW178.28 g/mol
LogP1.11
Rot. Bonds2

About (4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole

(4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole (PubChem CID 143526408) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is (4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole.

Molecular Properties

Compound Name(4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole
PubChem CID143526408
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name(4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole
SMILESCC/C=c1/nc(C)n(C)/c1=C/CC
InChIInChI=1S/C11H18N2/c1-5-7-10-11(8-6-2)13(4)9(3)12-10/h7-8H,5-6H2,1-4H3/b10-7+,11-8+
InChIKeyMOORMYUOWGWREQ-AMMQDNIMSA-N
XLogP1.11
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole?
The IUPAC name of (4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole (CID 143526408) is (4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole.
What is the SMILES notation for (4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole?
The canonical SMILES for (4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole is CC/C=c1/nc(C)n(C)/c1=C/CC.
What is the InChIKey of (4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole?
The InChIKey is MOORMYUOWGWREQ-AMMQDNIMSA-N. The full InChI is InChI=1S/C11H18N2/c1-5-7-10-11(8-6-2)13(4)9(3)12-10/h7-8H,5-6H2,1-4H3/b10-7+,11-8+.
What are the key properties of (4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole?
(4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole has a molecular weight of 178.28 g/mol, XLogP of 1.11, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4E,5E)-1,2-dimethyl-4,5-di(propylidene)imidazole is sourced from PubChem (CID 143526408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).