2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine

C14H12N2 — CID 175267365

IUPAC2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine
SMILESCC(=C=Cc1ccccn1)c1cccnc1
InChIInChI=1S/C14H12N2/c1-12(13-5-4-9-15-11-13)7-8-14-6-2-3-10-16-14/h2-6,8-11H,1H3
InChIKeyMCYCKPLGJQGVBV-UHFFFAOYSA-N
MW208.26 g/mol
LogP3.19
Rot. Bonds2

About 2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine

2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine (PubChem CID 175267365) has the molecular formula C14H12N2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine.

Molecular Properties

Compound Name2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine
PubChem CID175267365
Molecular FormulaC14H12N2
Molecular Weight208.26 g/mol
Exact Mass208.10
IUPAC Name2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine
SMILESCC(=C=Cc1ccccn1)c1cccnc1
InChIInChI=1S/C14H12N2/c1-12(13-5-4-9-15-11-13)7-8-14-6-2-3-10-16-14/h2-6,8-11H,1H3
InChIKeyMCYCKPLGJQGVBV-UHFFFAOYSA-N
XLogP3.19
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(E)-3-pyridin-2-yl-1-pyridin-3-ylprop-2-en-1-one
CID 19553305
N-(pyridin-2-ylmethylideneamino)pyridine-3-carboxamide
CID 577497
2-(2-piperidin-1-yl-2-pyridin-3-ylethenyl)pyridine
CID 4601342
3-[(Z)-but-2-en-2-yl]pyridine
CID 101055092
1-pyridin-3-ylethanethione
CID 11815891
(E)-1-pyridin-3-yl-N-[(E)-1-pyridin-3-ylethylideneamino]ethanimine
CID 5405316
1-pyridin-3-ylethanone;hydrochloride
CID 69233376
N'-pyridin-2-ylpyridine-3-carbohydrazide
CID 69416476
N-[pyridin-2-yl(pyridin-3-yl)methylidene]hydroxylamine
CID 137225687
N-[2-(pyridine-3-carbonylamino)phenyl]pyridine-2-carboxamide
CID 108925361
N-[2-[[4-(3-pyridin-2-ylprop-2-enoyl)phenyl]carbamoylamino]ethyl]pyridine-3-carboxamide
CID 67013433
[3-(3-pyridin-3-ylbut-2-en-2-yl)phenyl]boronic acid
CID 175457370

Frequently Asked Questions

What is the IUPAC name of 2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine?
The IUPAC name of 2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine (CID 175267365) is 2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine.
What is the SMILES notation for 2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine?
The canonical SMILES for 2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine is CC(=C=Cc1ccccn1)c1cccnc1.
What is the InChIKey of 2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine?
The InChIKey is MCYCKPLGJQGVBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2/c1-12(13-5-4-9-15-11-13)7-8-14-6-2-3-10-16-14/h2-6,8-11H,1H3.
What are the key properties of 2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine?
2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine has a molecular weight of 208.26 g/mol, XLogP of 3.19, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-pyridin-3-ylbuta-1,2-dienyl)pyridine is sourced from PubChem (CID 175267365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).