4-ethylsulfanyl-6-methylpyridazin-3-amine

C7H11N3S — CID 6410623

IUPAC4-ethylsulfanyl-6-methylpyridazin-3-amine
SMILESCCSc1cc(C)nnc1N
InChIInChI=1S/C7H11N3S/c1-3-11-6-4-5(2)9-10-7(6)8/h4H,3H2,1-2H3,(H2,8,10)
InChIKeyPULSWKXBFKEEOS-UHFFFAOYSA-N
MW169.25 g/mol
LogP1.48
Rot. Bonds2

About 4-ethylsulfanyl-6-methylpyridazin-3-amine

4-ethylsulfanyl-6-methylpyridazin-3-amine (PubChem CID 6410623) has the molecular formula C7H11N3S and a molecular weight of 169.25 g/mol. Its IUPAC name is 4-ethylsulfanyl-6-methylpyridazin-3-amine.

Molecular Properties

Compound Name4-ethylsulfanyl-6-methylpyridazin-3-amine
PubChem CID6410623
Molecular FormulaC7H11N3S
Molecular Weight169.25 g/mol
Exact Mass169.07
IUPAC Name4-ethylsulfanyl-6-methylpyridazin-3-amine
SMILESCCSc1cc(C)nnc1N
InChIInChI=1S/C7H11N3S/c1-3-11-6-4-5(2)9-10-7(6)8/h4H,3H2,1-2H3,(H2,8,10)
InChIKeyPULSWKXBFKEEOS-UHFFFAOYSA-N
XLogP1.48
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-ethylsulfanyl-6-methylpyridazin-3-amine?
The IUPAC name of 4-ethylsulfanyl-6-methylpyridazin-3-amine (CID 6410623) is 4-ethylsulfanyl-6-methylpyridazin-3-amine.
What is the SMILES notation for 4-ethylsulfanyl-6-methylpyridazin-3-amine?
The canonical SMILES for 4-ethylsulfanyl-6-methylpyridazin-3-amine is CCSc1cc(C)nnc1N.
What is the InChIKey of 4-ethylsulfanyl-6-methylpyridazin-3-amine?
The InChIKey is PULSWKXBFKEEOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3S/c1-3-11-6-4-5(2)9-10-7(6)8/h4H,3H2,1-2H3,(H2,8,10).
What are the key properties of 4-ethylsulfanyl-6-methylpyridazin-3-amine?
4-ethylsulfanyl-6-methylpyridazin-3-amine has a molecular weight of 169.25 g/mol, XLogP of 1.48, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylsulfanyl-6-methylpyridazin-3-amine is sourced from PubChem (CID 6410623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).