2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine

C27H23N — CID 175403185

IUPAC2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine
SMILESCC(C=Cc1ccccc1)c1ccc(-c2ccccc2)c(-c2ccccc2)n1
InChIInChI=1S/C27H23N/c1-21(17-18-22-11-5-2-6-12-22)26-20-19-25(23-13-7-3-8-14-23)27(28-26)24-15-9-4-10-16-24/h2-21H,1H3
InChIKeyIBVGVKKPOIXQFF-UHFFFAOYSA-N
MW361.49 g/mol
LogP7.23
Rot. Bonds5

About 2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine

2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine (PubChem CID 175403185) has the molecular formula C27H23N and a molecular weight of 361.49 g/mol. Its IUPAC name is 2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine.

Molecular Properties

Compound Name2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine
PubChem CID175403185
Molecular FormulaC27H23N
Molecular Weight361.49 g/mol
Exact Mass361.18
IUPAC Name2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine
SMILESCC(C=Cc1ccccc1)c1ccc(-c2ccccc2)c(-c2ccccc2)n1
InChIInChI=1S/C27H23N/c1-21(17-18-22-11-5-2-6-12-22)26-20-19-25(23-13-7-3-8-14-23)27(28-26)24-15-9-4-10-16-24/h2-21H,1H3
InChIKeyIBVGVKKPOIXQFF-UHFFFAOYSA-N
XLogP7.23
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.49
LogP ≤ 57.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-phenyl-2-(4-phenylbut-3-en-2-yl)pyridine
CID 175403144
1-phenyl-4-[(E)-3-(4-phenylphenyl)but-1-enyl]benzene
CID 102073243
trimethyl(2-phenylethenyl)phosphanium
CID 69015838
2-(4-phenylbut-3-en-2-yl)-1H-imidazole
CID 70565796
1-methyl-4-[(E,2R)-4-phenylbut-3-en-2-yl]benzene
CID 102584248
1-[(E,2S)-4-phenylbut-3-en-2-yl]naphthalene
CID 102229934
2,3,4-triphenyl-6-propan-2-ylpyridine
CID 134840610
(Z,2R)-4-phenylbut-3-en-2-ol
CID 11457765
N-methyl-N-[6-[(E)-4-phenylbut-3-en-2-yl]-3-pyridinyl]benzamide
CID 175403316
[(E)-4,4-difluoro-3-methylbut-1-enyl]benzene
CID 132509961
(E)-4-(4-phenylphenyl)but-3-en-2-amine
CID 83350140
5-(2,2-dimethylpropoxymethyl)-2-(4-phenylbut-3-en-2-yl)pyridine
CID 175545857

Frequently Asked Questions

What is the IUPAC name of 2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine?
The IUPAC name of 2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine (CID 175403185) is 2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine.
What is the SMILES notation for 2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine?
The canonical SMILES for 2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine is CC(C=Cc1ccccc1)c1ccc(-c2ccccc2)c(-c2ccccc2)n1.
What is the InChIKey of 2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine?
The InChIKey is IBVGVKKPOIXQFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23N/c1-21(17-18-22-11-5-2-6-12-22)26-20-19-25(23-13-7-3-8-14-23)27(28-26)24-15-9-4-10-16-24/h2-21H,1H3.
What are the key properties of 2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine?
2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine has a molecular weight of 361.49 g/mol, XLogP of 7.23, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diphenyl-6-(4-phenylbut-3-en-2-yl)pyridine is sourced from PubChem (CID 175403185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).