6-(3-methylbutoxy)pyridazin-3-amine

C9H15N3O — CID 112693082

IUPAC6-(3-methylbutoxy)pyridazin-3-amine
SMILESCC(C)CCOc1ccc(N)nn1
InChIInChI=1S/C9H15N3O/c1-7(2)5-6-13-9-4-3-8(10)11-12-9/h3-4,7H,5-6H2,1-2H3,(H2,10,11)
InChIKeyDZNSGAHVWLZPJL-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.48
Rot. Bonds4

About 6-(3-methylbutoxy)pyridazin-3-amine

6-(3-methylbutoxy)pyridazin-3-amine (PubChem CID 112693082) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 6-(3-methylbutoxy)pyridazin-3-amine.

Molecular Properties

Compound Name6-(3-methylbutoxy)pyridazin-3-amine
PubChem CID112693082
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name6-(3-methylbutoxy)pyridazin-3-amine
SMILESCC(C)CCOc1ccc(N)nn1
InChIInChI=1S/C9H15N3O/c1-7(2)5-6-13-9-4-3-8(10)11-12-9/h3-4,7H,5-6H2,1-2H3,(H2,10,11)
InChIKeyDZNSGAHVWLZPJL-UHFFFAOYSA-N
XLogP1.48
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-hexoxypyridazin-3-amine
CID 11959089
2-ethoxy-6-(3-methylbutoxy)pyridin-3-amine
CID 43262247
[6-(4-methylpentoxy)pyridazin-3-yl]methanol
CID 61255070
5-methyl-2-(3-methylbutoxy)pyridin-4-amine
CID 83266368
2-methyl-N-[[6-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine
CID 62289979
4-chloro-6-(3-methylbutoxy)pyrimidin-2-amine
CID 80739777
[4-(3-methylbutoxy)pyrimidin-2-yl]hydrazine
CID 80909283
6-(3-methylbutoxy)pyridine-3-carboxylic acid
CID 22219927
2-methyl-5-(3-methylbutoxy)pyrazine
CID 176962198
2-methoxy-6-(4-methylpentoxy)pyridin-3-amine
CID 43262525
4-N-methyl-6-(3-methylbutoxy)pyrimidine-2,4-diamine
CID 80858428
5-iodo-2-(3-methylbutoxy)aniline
CID 66080957

Frequently Asked Questions

What is the IUPAC name of 6-(3-methylbutoxy)pyridazin-3-amine?
The IUPAC name of 6-(3-methylbutoxy)pyridazin-3-amine (CID 112693082) is 6-(3-methylbutoxy)pyridazin-3-amine.
What is the SMILES notation for 6-(3-methylbutoxy)pyridazin-3-amine?
The canonical SMILES for 6-(3-methylbutoxy)pyridazin-3-amine is CC(C)CCOc1ccc(N)nn1.
What is the InChIKey of 6-(3-methylbutoxy)pyridazin-3-amine?
The InChIKey is DZNSGAHVWLZPJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-7(2)5-6-13-9-4-3-8(10)11-12-9/h3-4,7H,5-6H2,1-2H3,(H2,10,11).
What are the key properties of 6-(3-methylbutoxy)pyridazin-3-amine?
6-(3-methylbutoxy)pyridazin-3-amine has a molecular weight of 181.24 g/mol, XLogP of 1.48, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methylbutoxy)pyridazin-3-amine is sourced from PubChem (CID 112693082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).