3,4-dimethyl-2-(3-phenylphenyl)pyridine

C19H17N — CID 59594024

IUPAC3,4-dimethyl-2-(3-phenylphenyl)pyridine
SMILESCc1ccnc(-c2cccc(-c3ccccc3)c2)c1C
InChIInChI=1S/C19H17N/c1-14-11-12-20-19(15(14)2)18-10-6-9-17(13-18)16-7-4-3-5-8-16/h3-13H,1-2H3
InChIKeyWPTRCPZFSSOETA-UHFFFAOYSA-N
MW259.35 g/mol
LogP5.03
Rot. Bonds2

About 3,4-dimethyl-2-(3-phenylphenyl)pyridine

3,4-dimethyl-2-(3-phenylphenyl)pyridine (PubChem CID 59594024) has the molecular formula C19H17N and a molecular weight of 259.35 g/mol. Its IUPAC name is 3,4-dimethyl-2-(3-phenylphenyl)pyridine.

Molecular Properties

Compound Name3,4-dimethyl-2-(3-phenylphenyl)pyridine
PubChem CID59594024
Molecular FormulaC19H17N
Molecular Weight259.35 g/mol
Exact Mass259.14
IUPAC Name3,4-dimethyl-2-(3-phenylphenyl)pyridine
SMILESCc1ccnc(-c2cccc(-c3ccccc3)c2)c1C
InChIInChI=1S/C19H17N/c1-14-11-12-20-19(15(14)2)18-10-6-9-17(13-18)16-7-4-3-5-8-16/h3-13H,1-2H3
InChIKeyWPTRCPZFSSOETA-UHFFFAOYSA-N
XLogP5.03
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500259.35
LogP ≤ 55.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-2-(3-phenylphenyl)pyridine?
The IUPAC name of 3,4-dimethyl-2-(3-phenylphenyl)pyridine (CID 59594024) is 3,4-dimethyl-2-(3-phenylphenyl)pyridine.
What is the SMILES notation for 3,4-dimethyl-2-(3-phenylphenyl)pyridine?
The canonical SMILES for 3,4-dimethyl-2-(3-phenylphenyl)pyridine is Cc1ccnc(-c2cccc(-c3ccccc3)c2)c1C.
What is the InChIKey of 3,4-dimethyl-2-(3-phenylphenyl)pyridine?
The InChIKey is WPTRCPZFSSOETA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N/c1-14-11-12-20-19(15(14)2)18-10-6-9-17(13-18)16-7-4-3-5-8-16/h3-13H,1-2H3.
What are the key properties of 3,4-dimethyl-2-(3-phenylphenyl)pyridine?
3,4-dimethyl-2-(3-phenylphenyl)pyridine has a molecular weight of 259.35 g/mol, XLogP of 5.03, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-2-(3-phenylphenyl)pyridine is sourced from PubChem (CID 59594024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).