5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine

C9H11N5O — CID 104670086

IUPAC5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine
SMILESCCc1nnc(C)cc1-c1nnc(N)o1
InChIInChI=1S/C9H11N5O/c1-3-7-6(4-5(2)11-12-7)8-13-14-9(10)15-8/h4H,3H2,1-2H3,(H2,10,14)
InChIKeyQQJPNUMLEICCNE-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.98
Rot. Bonds2

About 5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine

5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine (PubChem CID 104670086) has the molecular formula C9H11N5O and a molecular weight of 205.22 g/mol. Its IUPAC name is 5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine
PubChem CID104670086
Molecular FormulaC9H11N5O
Molecular Weight205.22 g/mol
Exact Mass205.10
IUPAC Name5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine
SMILESCCc1nnc(C)cc1-c1nnc(N)o1
InChIInChI=1S/C9H11N5O/c1-3-7-6(4-5(2)11-12-7)8-13-14-9(10)15-8/h4H,3H2,1-2H3,(H2,10,14)
InChIKeyQQJPNUMLEICCNE-UHFFFAOYSA-N
XLogP0.98
TPSA90.72 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine (CID 104670086) is 5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine is CCc1nnc(C)cc1-c1nnc(N)o1.
What is the InChIKey of 5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine?
The InChIKey is QQJPNUMLEICCNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O/c1-3-7-6(4-5(2)11-12-7)8-13-14-9(10)15-8/h4H,3H2,1-2H3,(H2,10,14).
What are the key properties of 5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine?
5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine has a molecular weight of 205.22 g/mol, XLogP of 0.98, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 104670086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).