(5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole

C9H14N2 — CID 137427544

IUPAC(5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole
SMILESCC/C(C)=C\C=C1/CN=CN1
InChIInChI=1S/C9H14N2/c1-3-8(2)4-5-9-6-10-7-11-9/h4-5,7H,3,6H2,1-2H3,(H,10,11)/b8-4-,9-5+
InChIKeyVKBUGUGWSVPCAT-MVTUOISNSA-N
MW150.22 g/mol
LogP1.86
Rot. Bonds2

About (5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole

(5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole (PubChem CID 137427544) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is (5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole.

Molecular Properties

Compound Name(5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole
PubChem CID137427544
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name(5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole
SMILESCC/C(C)=C\C=C1/CN=CN1
InChIInChI=1S/C9H14N2/c1-3-8(2)4-5-9-6-10-7-11-9/h4-5,7H,3,6H2,1-2H3,(H,10,11)/b8-4-,9-5+
InChIKeyVKBUGUGWSVPCAT-MVTUOISNSA-N
XLogP1.86
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(E)-2-[[(2E,4E)-2-ethyl-5,6-difluorohexa-2,4-dienyl]amino]pent-2-enyl]-N'-methylmethanimidamide
CID 144287765
(4E,5E)-4-(2-fluoroethylidene)-5-(2-fluoropropylidene)-1H-imidazole
CID 144356998
(5E)-5-[(2Z)-penta-2,4-dienylidene]-1,4-dihydroimidazole
CID 88228822
5-[(Z)-but-1-enyl]-6-methyl-1,4-dihydropyrimidine
CID 89336052
8-Methyl-1,4,7,8-tetrahydropyrido[3,4-d]pyrimidine
CID 90291949
8-Methyl-3,7-dihydrocyclohepta[d]imidazole
CID 91065909
3,7-Dihydrocyclohepta[d]imidazole
CID 91179014
5-Methyl-1,5-dihydrocyclohepta[d]imidazole
CID 122463259
5,5-dimethyl-1H-cyclohepta[d]imidazole
CID 123139076
5-[(1E,3E)-2,3-dimethylhexa-1,3,5-trienyl]-6-methyl-1,4-dihydropyrimidin-4-amine
CID 123303165
4,4-dimethyl-7-methylidene-1H-1,3-diazepine
CID 123387213
N-[(3E)-2,6-dimethylhepta-1,3,5-trien-3-yl]-N'-methylmethanimidamide
CID 123434689

Frequently Asked Questions

What is the IUPAC name of (5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole?
The IUPAC name of (5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole (CID 137427544) is (5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole.
What is the SMILES notation for (5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole?
The canonical SMILES for (5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole is CC/C(C)=C\C=C1/CN=CN1.
What is the InChIKey of (5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole?
The InChIKey is VKBUGUGWSVPCAT-MVTUOISNSA-N. The full InChI is InChI=1S/C9H14N2/c1-3-8(2)4-5-9-6-10-7-11-9/h4-5,7H,3,6H2,1-2H3,(H,10,11)/b8-4-,9-5+.
What are the key properties of (5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole?
(5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole has a molecular weight of 150.22 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-[(Z)-3-methylpent-2-enylidene]-1,4-dihydroimidazole is sourced from PubChem (CID 137427544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).