3-(4-methylphenyl)-2-pyridin-2-ylpyridine

C17H14N2 — CID 138756955

IUPAC3-(4-methylphenyl)-2-pyridin-2-ylpyridine
SMILESCc1ccc(-c2cccnc2-c2ccccn2)cc1
InChIInChI=1S/C17H14N2/c1-13-7-9-14(10-8-13)15-5-4-12-19-17(15)16-6-2-3-11-18-16/h2-12H,1H3
InChIKeyDEYCJBTVDMPZFA-UHFFFAOYSA-N
MW246.31 g/mol
LogP4.12
Rot. Bonds2

About 3-(4-methylphenyl)-2-pyridin-2-ylpyridine

3-(4-methylphenyl)-2-pyridin-2-ylpyridine (PubChem CID 138756955) has the molecular formula C17H14N2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 3-(4-methylphenyl)-2-pyridin-2-ylpyridine.

Molecular Properties

Compound Name3-(4-methylphenyl)-2-pyridin-2-ylpyridine
PubChem CID138756955
Molecular FormulaC17H14N2
Molecular Weight246.31 g/mol
Exact Mass246.12
IUPAC Name3-(4-methylphenyl)-2-pyridin-2-ylpyridine
SMILESCc1ccc(-c2cccnc2-c2ccccn2)cc1
InChIInChI=1S/C17H14N2/c1-13-7-9-14(10-8-13)15-5-4-12-19-17(15)16-6-2-3-11-18-16/h2-12H,1H3
InChIKeyDEYCJBTVDMPZFA-UHFFFAOYSA-N
XLogP4.12
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methylphenyl)-2-pyridin-2-ylpyridine?
The IUPAC name of 3-(4-methylphenyl)-2-pyridin-2-ylpyridine (CID 138756955) is 3-(4-methylphenyl)-2-pyridin-2-ylpyridine.
What is the SMILES notation for 3-(4-methylphenyl)-2-pyridin-2-ylpyridine?
The canonical SMILES for 3-(4-methylphenyl)-2-pyridin-2-ylpyridine is Cc1ccc(-c2cccnc2-c2ccccn2)cc1.
What is the InChIKey of 3-(4-methylphenyl)-2-pyridin-2-ylpyridine?
The InChIKey is DEYCJBTVDMPZFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2/c1-13-7-9-14(10-8-13)15-5-4-12-19-17(15)16-6-2-3-11-18-16/h2-12H,1H3.
What are the key properties of 3-(4-methylphenyl)-2-pyridin-2-ylpyridine?
3-(4-methylphenyl)-2-pyridin-2-ylpyridine has a molecular weight of 246.31 g/mol, XLogP of 4.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylphenyl)-2-pyridin-2-ylpyridine is sourced from PubChem (CID 138756955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).