2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine

C19H16ClN — CID 171405080

IUPAC2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine
SMILESCCc1cnc(-c2ccc(Cl)cc2)cc1-c1ccccc1
InChIInChI=1S/C19H16ClN/c1-2-14-13-21-19(16-8-10-17(20)11-9-16)12-18(14)15-6-4-3-5-7-15/h3-13H,2H2,1H3
InChIKeyOVGDADHQHOFPSR-UHFFFAOYSA-N
MW293.80 g/mol
LogP5.63
Rot. Bonds3

About 2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine

2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine (PubChem CID 171405080) has the molecular formula C19H16ClN and a molecular weight of 293.80 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine
PubChem CID171405080
Molecular FormulaC19H16ClN
Molecular Weight293.80 g/mol
Exact Mass293.10
IUPAC Name2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine
SMILESCCc1cnc(-c2ccc(Cl)cc2)cc1-c1ccccc1
InChIInChI=1S/C19H16ClN/c1-2-14-13-21-19(16-8-10-17(20)11-9-16)12-18(14)15-6-4-3-5-7-15/h3-13H,2H2,1H3
InChIKeyOVGDADHQHOFPSR-UHFFFAOYSA-N
XLogP5.63
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.80
LogP ≤ 55.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine?
The IUPAC name of 2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine (CID 171405080) is 2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine.
What is the SMILES notation for 2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine?
The canonical SMILES for 2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine is CCc1cnc(-c2ccc(Cl)cc2)cc1-c1ccccc1.
What is the InChIKey of 2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine?
The InChIKey is OVGDADHQHOFPSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN/c1-2-14-13-21-19(16-8-10-17(20)11-9-16)12-18(14)15-6-4-3-5-7-15/h3-13H,2H2,1H3.
What are the key properties of 2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine?
2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine has a molecular weight of 293.80 g/mol, XLogP of 5.63, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-5-ethyl-4-phenylpyridine is sourced from PubChem (CID 171405080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).