2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine

C11H7N — CID 174650963

IUPAC2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine
SMILESc1ccc(-c2cc3ccc2=3)nc1
InChIInChI=1S/C11H7N/c1-2-6-12-11(3-1)10-7-8-4-5-9(8)10/h1-7H
InChIKeyHCTHRWXCGXDIRR-UHFFFAOYSA-N
MW153.18 g/mol
LogP2.35
Rot. Bonds1

About 2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine

2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine (PubChem CID 174650963) has the molecular formula C11H7N and a molecular weight of 153.18 g/mol. Its IUPAC name is 2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine.

Molecular Properties

Compound Name2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine
PubChem CID174650963
Molecular FormulaC11H7N
Molecular Weight153.18 g/mol
Exact Mass153.06
IUPAC Name2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine
SMILESc1ccc(-c2cc3ccc2=3)nc1
InChIInChI=1S/C11H7N/c1-2-6-12-11(3-1)10-7-8-4-5-9(8)10/h1-7H
InChIKeyHCTHRWXCGXDIRR-UHFFFAOYSA-N
XLogP2.35
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,5-dimethyl-4-pyridin-2-ylphenyl)pyridine
CID 118652406
nickel;tris(2-pyridin-2-ylpyridine)
CID 76737267
bis(2-pyridin-2-ylpyridine);ruthenium
CID 87118114
tris(2-pyridin-2-ylpyridine);ruthenium
CID 6100643
2-pyridin-2-ylpyridine;ruthenium(2+)
CID 140596360
2-pyridin-2-ylpyridine;hydroiodide
CID 172833113
2-pyridin-2-ylpyridine;rhenium;tetrachloride
CID 52939847
2-pyridin-2-ylpyridine;dihydroiodide
CID 173445353
4,8-dipyridin-2-yl-1,5-naphthyridine
CID 141460445
5,8-dipyridin-2-ylquinoxaline
CID 102128450
3-pyridin-2-yl-2-[(3-pyridin-2-yl-2-pyridinyl)disulfanyl]pyridine
CID 141048540
2-(2-pyridin-2-ylphenyl)pyrazine
CID 91494990

Frequently Asked Questions

What is the IUPAC name of 2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine?
The IUPAC name of 2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine (CID 174650963) is 2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine.
What is the SMILES notation for 2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine?
The canonical SMILES for 2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine is c1ccc(-c2cc3ccc2=3)nc1.
What is the InChIKey of 2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine?
The InChIKey is HCTHRWXCGXDIRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N/c1-2-6-12-11(3-1)10-7-8-4-5-9(8)10/h1-7H.
What are the key properties of 2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine?
2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine has a molecular weight of 153.18 g/mol, XLogP of 2.35, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bicyclo[2.2.0]hexa-1(4),2,5-trienyl)pyridine is sourced from PubChem (CID 174650963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).