3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine

C25H24N2 — CID 143453970

IUPAC3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine
SMILESCc1ccc(-c2ccncc2)cc1.Cc1ccc(-c2cncc(C)c2)cc1
InChIInChI=1S/C13H13N.C12H11N/c1-10-3-5-12(6-4-10)13-7-11(2)8-14-9-13;1-10-2-4-11(5-3-10)12-6-8-13-9-7-12/h3-9H,1-2H3;2-9H,1H3
InChIKeyPZHKUZDVYSBCDD-UHFFFAOYSA-N
MW352.48 g/mol
LogP6.42
Rot. Bonds2

About 3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine

3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine (PubChem CID 143453970) has the molecular formula C25H24N2 and a molecular weight of 352.48 g/mol. Its IUPAC name is 3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine.

Molecular Properties

Compound Name3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine
PubChem CID143453970
Molecular FormulaC25H24N2
Molecular Weight352.48 g/mol
Exact Mass352.19
IUPAC Name3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine
SMILESCc1ccc(-c2ccncc2)cc1.Cc1ccc(-c2cncc(C)c2)cc1
InChIInChI=1S/C13H13N.C12H11N/c1-10-3-5-12(6-4-10)13-7-11(2)8-14-9-13;1-10-2-4-11(5-3-10)12-6-8-13-9-7-12/h3-9H,1-2H3;2-9H,1H3
InChIKeyPZHKUZDVYSBCDD-UHFFFAOYSA-N
XLogP6.42
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.48
LogP ≤ 56.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine?
The IUPAC name of 3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine (CID 143453970) is 3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine.
What is the SMILES notation for 3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine?
The canonical SMILES for 3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine is Cc1ccc(-c2ccncc2)cc1.Cc1ccc(-c2cncc(C)c2)cc1.
What is the InChIKey of 3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine?
The InChIKey is PZHKUZDVYSBCDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N.C12H11N/c1-10-3-5-12(6-4-10)13-7-11(2)8-14-9-13;1-10-2-4-11(5-3-10)12-6-8-13-9-7-12/h3-9H,1-2H3;2-9H,1H3.
What are the key properties of 3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine?
3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine has a molecular weight of 352.48 g/mol, XLogP of 6.42, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine is sourced from PubChem (CID 143453970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).