3-methyl-5-(4-methyl-2-pyridinyl)pyridine

C12H12N2 — CID 54101301

IUPAC3-methyl-5-(4-methyl-2-pyridinyl)pyridine
SMILESCc1cncc(-c2cc(C)ccn2)c1
InChIInChI=1S/C12H12N2/c1-9-3-4-14-12(6-9)11-5-10(2)7-13-8-11/h3-8H,1-2H3
InChIKeyNARMDANUUNULOH-UHFFFAOYSA-N
MW184.24 g/mol
LogP2.76
Rot. Bonds1

About 3-methyl-5-(4-methyl-2-pyridinyl)pyridine

3-methyl-5-(4-methyl-2-pyridinyl)pyridine (PubChem CID 54101301) has the molecular formula C12H12N2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 3-methyl-5-(4-methyl-2-pyridinyl)pyridine.

Molecular Properties

Compound Name3-methyl-5-(4-methyl-2-pyridinyl)pyridine
PubChem CID54101301
Molecular FormulaC12H12N2
Molecular Weight184.24 g/mol
Exact Mass184.10
IUPAC Name3-methyl-5-(4-methyl-2-pyridinyl)pyridine
SMILESCc1cncc(-c2cc(C)ccn2)c1
InChIInChI=1S/C12H12N2/c1-9-3-4-14-12(6-9)11-5-10(2)7-13-8-11/h3-8H,1-2H3
InChIKeyNARMDANUUNULOH-UHFFFAOYSA-N
XLogP2.76
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 52.76
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-methyl-2-pyridinyl)pyridine?
The IUPAC name of 3-methyl-5-(4-methyl-2-pyridinyl)pyridine (CID 54101301) is 3-methyl-5-(4-methyl-2-pyridinyl)pyridine.
What is the SMILES notation for 3-methyl-5-(4-methyl-2-pyridinyl)pyridine?
The canonical SMILES for 3-methyl-5-(4-methyl-2-pyridinyl)pyridine is Cc1cncc(-c2cc(C)ccn2)c1.
What is the InChIKey of 3-methyl-5-(4-methyl-2-pyridinyl)pyridine?
The InChIKey is NARMDANUUNULOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2/c1-9-3-4-14-12(6-9)11-5-10(2)7-13-8-11/h3-8H,1-2H3.
What are the key properties of 3-methyl-5-(4-methyl-2-pyridinyl)pyridine?
3-methyl-5-(4-methyl-2-pyridinyl)pyridine has a molecular weight of 184.24 g/mol, XLogP of 2.76, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(4-methyl-2-pyridinyl)pyridine is sourced from PubChem (CID 54101301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).