4-chloro-5-methyl-2,3-diphenylpyridine

C18H14ClN — CID 164527932

IUPAC4-chloro-5-methyl-2,3-diphenylpyridine
SMILESCc1cnc(-c2ccccc2)c(-c2ccccc2)c1Cl
InChIInChI=1S/C18H14ClN/c1-13-12-20-18(15-10-6-3-7-11-15)16(17(13)19)14-8-4-2-5-9-14/h2-12H,1H3
InChIKeySDIAFDOLMZATPA-UHFFFAOYSA-N
MW279.77 g/mol
LogP5.38
Rot. Bonds2

About 4-chloro-5-methyl-2,3-diphenylpyridine

4-chloro-5-methyl-2,3-diphenylpyridine (PubChem CID 164527932) has the molecular formula C18H14ClN and a molecular weight of 279.77 g/mol. Its IUPAC name is 4-chloro-5-methyl-2,3-diphenylpyridine.

Molecular Properties

Compound Name4-chloro-5-methyl-2,3-diphenylpyridine
PubChem CID164527932
Molecular FormulaC18H14ClN
Molecular Weight279.77 g/mol
Exact Mass279.08
IUPAC Name4-chloro-5-methyl-2,3-diphenylpyridine
SMILESCc1cnc(-c2ccccc2)c(-c2ccccc2)c1Cl
InChIInChI=1S/C18H14ClN/c1-13-12-20-18(15-10-6-3-7-11-15)16(17(13)19)14-8-4-2-5-9-14/h2-12H,1H3
InChIKeySDIAFDOLMZATPA-UHFFFAOYSA-N
XLogP5.38
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500279.77
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-5-methyl-2,3-diphenylpyridine?
The IUPAC name of 4-chloro-5-methyl-2,3-diphenylpyridine (CID 164527932) is 4-chloro-5-methyl-2,3-diphenylpyridine.
What is the SMILES notation for 4-chloro-5-methyl-2,3-diphenylpyridine?
The canonical SMILES for 4-chloro-5-methyl-2,3-diphenylpyridine is Cc1cnc(-c2ccccc2)c(-c2ccccc2)c1Cl.
What is the InChIKey of 4-chloro-5-methyl-2,3-diphenylpyridine?
The InChIKey is SDIAFDOLMZATPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClN/c1-13-12-20-18(15-10-6-3-7-11-15)16(17(13)19)14-8-4-2-5-9-14/h2-12H,1H3.
What are the key properties of 4-chloro-5-methyl-2,3-diphenylpyridine?
4-chloro-5-methyl-2,3-diphenylpyridine has a molecular weight of 279.77 g/mol, XLogP of 5.38, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5-methyl-2,3-diphenylpyridine is sourced from PubChem (CID 164527932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).