2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine

C34H28N2 — CID 54097207

IUPAC2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine
SMILESCc1cc(C=C(c2ccccc2)c2ccccn2)c(C)cc1C=C(c1ccccc1)c1ccccn1
InChIInChI=1S/C34H28N2/c1-25-21-30(24-32(28-15-7-4-8-16-28)34-18-10-12-20-36-34)26(2)22-29(25)23-31(27-13-5-3-6-14-27)33-17-9-11-19-35-33/h3-24H,1-2H3
InChIKeyMXYRDCIFNQQXRP-UHFFFAOYSA-N
MW464.61 g/mol
LogP8.27
Rot. Bonds6

About 2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine

2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine (PubChem CID 54097207) has the molecular formula C34H28N2 and a molecular weight of 464.61 g/mol. Its IUPAC name is 2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine.

Molecular Properties

Compound Name2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine
PubChem CID54097207
Molecular FormulaC34H28N2
Molecular Weight464.61 g/mol
Exact Mass464.23
IUPAC Name2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine
SMILESCc1cc(C=C(c2ccccc2)c2ccccn2)c(C)cc1C=C(c1ccccc1)c1ccccn1
InChIInChI=1S/C34H28N2/c1-25-21-30(24-32(28-15-7-4-8-16-28)34-18-10-12-20-36-34)26(2)22-29(25)23-31(27-13-5-3-6-14-27)33-17-9-11-19-35-33/h3-24H,1-2H3
InChIKeyMXYRDCIFNQQXRP-UHFFFAOYSA-N
XLogP8.27
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.61
LogP ≤ 58.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[2,3-dimethyl-6-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine
CID 70365717
4-(2-phenyl-1-pyridin-2-ylethenyl)pyridine-2,6-diamine
CID 155099349
2-(1-phenylhept-1-enyl)pyridine
CID 71123883
3-(2,5-dimethylphenyl)-2-pyridin-2-ylprop-2-enenitrile
CID 5217687
gadolinium;pyridine-2-carboxylic acid
CID 175231422
1,4-bis[(E)-2-[4-(2,2-diphenylethenyl)phenyl]ethenyl]-2,5-dimethylbenzene
CID 20678111
2-[2-[(E)-1,2-diphenylethenyl]-6-methylphenyl]pyridine
CID 101134171
hafnium;pyridine-2-carboxylic acid
CID 175130925
pyridine-2-carboxylic acid;tungsten
CID 88770661
CID 173156131
CID 173156131
CID 175246691
CID 175246691
europium;pyridine-2-carboxylic acid
CID 174808227

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine?
The IUPAC name of 2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine (CID 54097207) is 2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine.
What is the SMILES notation for 2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine?
The canonical SMILES for 2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine is Cc1cc(C=C(c2ccccc2)c2ccccn2)c(C)cc1C=C(c1ccccc1)c1ccccn1.
What is the InChIKey of 2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine?
The InChIKey is MXYRDCIFNQQXRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H28N2/c1-25-21-30(24-32(28-15-7-4-8-16-28)34-18-10-12-20-36-34)26(2)22-29(25)23-31(27-13-5-3-6-14-27)33-17-9-11-19-35-33/h3-24H,1-2H3.
What are the key properties of 2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine?
2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine has a molecular weight of 464.61 g/mol, XLogP of 8.27, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2,5-dimethyl-4-(2-phenyl-2-pyridin-2-ylethenyl)phenyl]-1-phenylethenyl]pyridine is sourced from PubChem (CID 54097207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).