3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine

C16H14N4 — CID 118345277

IUPAC3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine
SMILESCc1ccc(-c2ccc(-c3ccc(C)nn3)cn2)cn1
InChIInChI=1S/C16H14N4/c1-11-3-5-13(9-17-11)15-8-6-14(10-18-15)16-7-4-12(2)19-20-16/h3-10H,1-2H3
InChIKeyYVHDYNFMMAMOHN-UHFFFAOYSA-N
MW262.32 g/mol
LogP3.22
Rot. Bonds2

About 3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine

3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine (PubChem CID 118345277) has the molecular formula C16H14N4 and a molecular weight of 262.32 g/mol. Its IUPAC name is 3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine.

Molecular Properties

Compound Name3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine
PubChem CID118345277
Molecular FormulaC16H14N4
Molecular Weight262.32 g/mol
Exact Mass262.12
IUPAC Name3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine
SMILESCc1ccc(-c2ccc(-c3ccc(C)nn3)cn2)cn1
InChIInChI=1S/C16H14N4/c1-11-3-5-13(9-17-11)15-8-6-14(10-18-15)16-7-4-12(2)19-20-16/h3-10H,1-2H3
InChIKeyYVHDYNFMMAMOHN-UHFFFAOYSA-N
XLogP3.22
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.32
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine?
The IUPAC name of 3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine (CID 118345277) is 3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine.
What is the SMILES notation for 3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine?
The canonical SMILES for 3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine is Cc1ccc(-c2ccc(-c3ccc(C)nn3)cn2)cn1.
What is the InChIKey of 3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine?
The InChIKey is YVHDYNFMMAMOHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4/c1-11-3-5-13(9-17-11)15-8-6-14(10-18-15)16-7-4-12(2)19-20-16/h3-10H,1-2H3.
What are the key properties of 3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine?
3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine has a molecular weight of 262.32 g/mol, XLogP of 3.22, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-[6-(6-methyl-3-pyridinyl)-3-pyridinyl]pyridazine is sourced from PubChem (CID 118345277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).