3,4,6-trimethyl-5-propylpyridazine

C10H16N2 — CID 90932914

IUPAC3,4,6-trimethyl-5-propylpyridazine
SMILESCCCc1c(C)nnc(C)c1C
InChIInChI=1S/C10H16N2/c1-5-6-10-7(2)8(3)11-12-9(10)4/h5-6H2,1-4H3
InChIKeyPPGSLNNUPXBXSI-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.35
Rot. Bonds2

About 3,4,6-trimethyl-5-propylpyridazine

3,4,6-trimethyl-5-propylpyridazine (PubChem CID 90932914) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 3,4,6-trimethyl-5-propylpyridazine.

Molecular Properties

Compound Name3,4,6-trimethyl-5-propylpyridazine
PubChem CID90932914
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name3,4,6-trimethyl-5-propylpyridazine
SMILESCCCc1c(C)nnc(C)c1C
InChIInChI=1S/C10H16N2/c1-5-6-10-7(2)8(3)11-12-9(10)4/h5-6H2,1-4H3
InChIKeyPPGSLNNUPXBXSI-UHFFFAOYSA-N
XLogP2.35
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4,6-trimethyl-5-propylpyridazine?
The IUPAC name of 3,4,6-trimethyl-5-propylpyridazine (CID 90932914) is 3,4,6-trimethyl-5-propylpyridazine.
What is the SMILES notation for 3,4,6-trimethyl-5-propylpyridazine?
The canonical SMILES for 3,4,6-trimethyl-5-propylpyridazine is CCCc1c(C)nnc(C)c1C.
What is the InChIKey of 3,4,6-trimethyl-5-propylpyridazine?
The InChIKey is PPGSLNNUPXBXSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-5-6-10-7(2)8(3)11-12-9(10)4/h5-6H2,1-4H3.
What are the key properties of 3,4,6-trimethyl-5-propylpyridazine?
3,4,6-trimethyl-5-propylpyridazine has a molecular weight of 164.25 g/mol, XLogP of 2.35, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,6-trimethyl-5-propylpyridazine is sourced from PubChem (CID 90932914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).