2,3-dimethyl-5-pyridin-3-ylpyridine

C12H12N2 — CID 122608541

IUPAC2,3-dimethyl-5-pyridin-3-ylpyridine
SMILESCc1cc(-c2cccnc2)cnc1C
InChIInChI=1S/C12H12N2/c1-9-6-12(8-14-10(9)2)11-4-3-5-13-7-11/h3-8H,1-2H3
InChIKeyPLBSIKVYUULDAZ-UHFFFAOYSA-N
MW184.24 g/mol
LogP2.76
Rot. Bonds1

About 2,3-dimethyl-5-pyridin-3-ylpyridine

2,3-dimethyl-5-pyridin-3-ylpyridine (PubChem CID 122608541) has the molecular formula C12H12N2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 2,3-dimethyl-5-pyridin-3-ylpyridine.

Molecular Properties

Compound Name2,3-dimethyl-5-pyridin-3-ylpyridine
PubChem CID122608541
Molecular FormulaC12H12N2
Molecular Weight184.24 g/mol
Exact Mass184.10
IUPAC Name2,3-dimethyl-5-pyridin-3-ylpyridine
SMILESCc1cc(-c2cccnc2)cnc1C
InChIInChI=1S/C12H12N2/c1-9-6-12(8-14-10(9)2)11-4-3-5-13-7-11/h3-8H,1-2H3
InChIKeyPLBSIKVYUULDAZ-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 2,3-dimethyl-5-pyridin-3-ylpyridine?
The IUPAC name of 2,3-dimethyl-5-pyridin-3-ylpyridine (CID 122608541) is 2,3-dimethyl-5-pyridin-3-ylpyridine.
What is the SMILES notation for 2,3-dimethyl-5-pyridin-3-ylpyridine?
The canonical SMILES for 2,3-dimethyl-5-pyridin-3-ylpyridine is Cc1cc(-c2cccnc2)cnc1C.
What is the InChIKey of 2,3-dimethyl-5-pyridin-3-ylpyridine?
The InChIKey is PLBSIKVYUULDAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2/c1-9-6-12(8-14-10(9)2)11-4-3-5-13-7-11/h3-8H,1-2H3.
What are the key properties of 2,3-dimethyl-5-pyridin-3-ylpyridine?
2,3-dimethyl-5-pyridin-3-ylpyridine 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 2,3-dimethyl-5-pyridin-3-ylpyridine is sourced from PubChem (CID 122608541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).