4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine

C14H16N2 — CID 59083909

IUPAC4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine
SMILESCc1ccc(-c2c(C)cncc2C)nc1C
InChIInChI=1S/C14H16N2/c1-9-5-6-13(16-12(9)4)14-10(2)7-15-8-11(14)3/h5-8H,1-4H3
InChIKeyPHFUSHPMBCMDEU-UHFFFAOYSA-N
MW212.30 g/mol
LogP3.38
Rot. Bonds1

About 4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine

4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine (PubChem CID 59083909) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine.

Molecular Properties

Compound Name4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine
PubChem CID59083909
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine
SMILESCc1ccc(-c2c(C)cncc2C)nc1C
InChIInChI=1S/C14H16N2/c1-9-5-6-13(16-12(9)4)14-10(2)7-15-8-11(14)3/h5-8H,1-4H3
InChIKeyPHFUSHPMBCMDEU-UHFFFAOYSA-N
XLogP3.38
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine?
The IUPAC name of 4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine (CID 59083909) is 4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine.
What is the SMILES notation for 4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine?
The canonical SMILES for 4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine is Cc1ccc(-c2c(C)cncc2C)nc1C.
What is the InChIKey of 4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine?
The InChIKey is PHFUSHPMBCMDEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-9-5-6-13(16-12(9)4)14-10(2)7-15-8-11(14)3/h5-8H,1-4H3.
What are the key properties of 4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine?
4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine has a molecular weight of 212.30 g/mol, XLogP of 3.38, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5,6-dimethyl-2-pyridinyl)-3,5-dimethylpyridine is sourced from PubChem (CID 59083909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).