4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine

C27H19N — CID 171662069

IUPAC4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine
SMILESC(=C(/c1ccncc1)c1ccc2ccccc2c1)\c1ccc2ccccc2c1
InChIInChI=1S/C27H19N/c1-3-7-24-17-20(9-10-21(24)5-1)18-27(23-13-15-28-16-14-23)26-12-11-22-6-2-4-8-25(22)19-26/h1-19H/b27-18-
InChIKeyYQDZBKOOUMYBIQ-IMRQLAEWSA-N
MW357.46 g/mol
LogP6.98
Rot. Bonds3

About 4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine

4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine (PubChem CID 171662069) has the molecular formula C27H19N and a molecular weight of 357.46 g/mol. Its IUPAC name is 4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine.

Molecular Properties

Compound Name4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine
PubChem CID171662069
Molecular FormulaC27H19N
Molecular Weight357.46 g/mol
Exact Mass357.15
IUPAC Name4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine
SMILESC(=C(/c1ccncc1)c1ccc2ccccc2c1)\c1ccc2ccccc2c1
InChIInChI=1S/C27H19N/c1-3-7-24-17-20(9-10-21(24)5-1)18-27(23-13-15-28-16-14-23)26-12-11-22-6-2-4-8-25(22)19-26/h1-19H/b27-18-
InChIKeyYQDZBKOOUMYBIQ-IMRQLAEWSA-N
XLogP6.98
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.46
LogP ≤ 56.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

2-(1,2-dinaphthalen-2-ylethenyl)naphthalene
CID 171662067
4-(2,2-dinaphthalen-2-ylethenyl)-N,N-bis[4-(2,2-dinaphthalen-2-ylethenyl)phenyl]aniline;4-(2,2-dipyridin-4-ylethenyl)-N,N-bis[4-(2,2-dipyridin-4-ylethenyl)phenyl]aniline;tris[4-(2,2-diphenylethenyl)phenyl]phosphane
CID 158789945
2-(2,2-diphenylethenyl)-6-[2-[6-(2-naphthalen-2-ylethenyl)naphthalen-2-yl]ethenyl]naphthalene
CID 72565680
2-(2,2-diphenylethenyl)anthracene
CID 155667641
9-[4-[2-(4-methoxyphenyl)-2-naphthalen-2-ylethenyl]phenyl]-10-phenylanthracene
CID 72576126
trimethyl-(2-naphthalen-2-yl-1-trimethylsilylethenyl)silane
CID 101475469
(E)-1-naphthalen-2-ylprop-1-en-2-amine
CID 20741960
2-(2-bromo-2-fluoroethenyl)naphthalene
CID 71421108
3-naphthalen-2-yl-3-phenylprop-2-enoic acid
CID 54114059
2-bromo-1-naphthalen-2-yl-2-pyridin-4-ylethanone
CID 22282349
(Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid
CID 67704998
3-[4-[2-[4-[4-[2-[4-(2-carboxy-2-isocyanoethenyl)phenyl]ethenyl]-N-[4-(2-naphthalen-2-yl-2-phenylethenyl)phenyl]anilino]phenyl]ethenyl]phenyl]-2-isocyanoprop-2-enoic acid
CID 76636409

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine?
The IUPAC name of 4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine (CID 171662069) is 4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine.
What is the SMILES notation for 4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine?
The canonical SMILES for 4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine is C(=C(/c1ccncc1)c1ccc2ccccc2c1)\c1ccc2ccccc2c1.
What is the InChIKey of 4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine?
The InChIKey is YQDZBKOOUMYBIQ-IMRQLAEWSA-N. The full InChI is InChI=1S/C27H19N/c1-3-7-24-17-20(9-10-21(24)5-1)18-27(23-13-15-28-16-14-23)26-12-11-22-6-2-4-8-25(22)19-26/h1-19H/b27-18-.
What are the key properties of 4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine?
4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine has a molecular weight of 357.46 g/mol, XLogP of 6.98, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-1,2-dinaphthalen-2-ylethenyl]pyridine is sourced from PubChem (CID 171662069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).