3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile

C10H11N3 — CID 53441182

IUPAC3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile
SMILESCN(C)C=Cc1cnccc1C#N
InChIInChI=1S/C10H11N3/c1-13(2)6-4-10-8-12-5-3-9(10)7-11/h3-6,8H,1-2H3
InChIKeyWSEAAEIFRDYXSA-UHFFFAOYSA-N
MW173.22 g/mol
LogP1.49
Rot. Bonds2

About 3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile

3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile (PubChem CID 53441182) has the molecular formula C10H11N3 and a molecular weight of 173.22 g/mol. Its IUPAC name is 3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile.

Molecular Properties

Compound Name3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile
PubChem CID53441182
Molecular FormulaC10H11N3
Molecular Weight173.22 g/mol
Exact Mass173.10
IUPAC Name3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile
SMILESCN(C)C=Cc1cnccc1C#N
InChIInChI=1S/C10H11N3/c1-13(2)6-4-10-8-12-5-3-9(10)7-11/h3-6,8H,1-2H3
InChIKeyWSEAAEIFRDYXSA-UHFFFAOYSA-N
XLogP1.49
TPSA39.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile?
The IUPAC name of 3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile (CID 53441182) is 3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile.
What is the SMILES notation for 3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile?
The canonical SMILES for 3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile is CN(C)C=Cc1cnccc1C#N.
What is the InChIKey of 3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile?
The InChIKey is WSEAAEIFRDYXSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3/c1-13(2)6-4-10-8-12-5-3-9(10)7-11/h3-6,8H,1-2H3.
What are the key properties of 3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile?
3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile has a molecular weight of 173.22 g/mol, XLogP of 1.49, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(dimethylamino)ethenyl]pyridine-4-carbonitrile is sourced from PubChem (CID 53441182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).