4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine

C24H20N2 — CID 102110528

IUPAC4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine
SMILESC=Cc1cnccc1-c1cc(C=C)c(-c2ccncc2C=C)cc1C=C
InChIInChI=1S/C24H20N2/c1-5-17-13-24(22-10-12-26-16-20(22)8-4)18(6-2)14-23(17)21-9-11-25-15-19(21)7-3/h5-16H,1-4H2
InChIKeyWRFMTZDBQVMGSA-UHFFFAOYSA-N
MW336.44 g/mol
LogP6.38
Rot. Bonds6

About 4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine

4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine (PubChem CID 102110528) has the molecular formula C24H20N2 and a molecular weight of 336.44 g/mol. Its IUPAC name is 4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine.

Molecular Properties

Compound Name4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine
PubChem CID102110528
Molecular FormulaC24H20N2
Molecular Weight336.44 g/mol
Exact Mass336.16
IUPAC Name4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine
SMILESC=Cc1cnccc1-c1cc(C=C)c(-c2ccncc2C=C)cc1C=C
InChIInChI=1S/C24H20N2/c1-5-17-13-24(22-10-12-26-16-20(22)8-4)18(6-2)14-23(17)21-9-11-25-15-19(21)7-3/h5-16H,1-4H2
InChIKeyWRFMTZDBQVMGSA-UHFFFAOYSA-N
XLogP6.38
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.44
LogP ≤ 56.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine?
The IUPAC name of 4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine (CID 102110528) is 4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine.
What is the SMILES notation for 4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine?
The canonical SMILES for 4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine is C=Cc1cnccc1-c1cc(C=C)c(-c2ccncc2C=C)cc1C=C.
What is the InChIKey of 4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine?
The InChIKey is WRFMTZDBQVMGSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2/c1-5-17-13-24(22-10-12-26-16-20(22)8-4)18(6-2)14-23(17)21-9-11-25-15-19(21)7-3/h5-16H,1-4H2.
What are the key properties of 4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine?
4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine has a molecular weight of 336.44 g/mol, XLogP of 6.38, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine is sourced from PubChem (CID 102110528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).