3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine

C11H13N3 — CID 11074146

IUPAC3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine
SMILESCN1CCN=C1/C=C/c1cccnc1
InChIInChI=1S/C11H13N3/c1-14-8-7-13-11(14)5-4-10-3-2-6-12-9-10/h2-6,9H,7-8H2,1H3/b5-4+
InChIKeyNZLRIWYSJLCXEW-SNAWJCMRSA-N
MW187.25 g/mol
LogP1.44
Rot. Bonds2

About 3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine

3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine (PubChem CID 11074146) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine.

Molecular Properties

Compound Name3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine
PubChem CID11074146
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine
SMILESCN1CCN=C1/C=C/c1cccnc1
InChIInChI=1S/C11H13N3/c1-14-8-7-13-11(14)5-4-10-3-2-6-12-9-10/h2-6,9H,7-8H2,1H3/b5-4+
InChIKeyNZLRIWYSJLCXEW-SNAWJCMRSA-N
XLogP1.44
TPSA28.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine?
The IUPAC name of 3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine (CID 11074146) is 3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine.
What is the SMILES notation for 3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine?
The canonical SMILES for 3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine is CN1CCN=C1/C=C/c1cccnc1.
What is the InChIKey of 3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine?
The InChIKey is NZLRIWYSJLCXEW-SNAWJCMRSA-N. The full InChI is InChI=1S/C11H13N3/c1-14-8-7-13-11(14)5-4-10-3-2-6-12-9-10/h2-6,9H,7-8H2,1H3/b5-4+.
What are the key properties of 3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine?
3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine has a molecular weight of 187.25 g/mol, XLogP of 1.44, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(E)-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethenyl]pyridine is sourced from PubChem (CID 11074146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).