6-hexoxypyridazin-3-amine

C10H17N3O — CID 11959089

IUPAC6-hexoxypyridazin-3-amine
SMILESCCCCCCOc1ccc(N)nn1
InChIInChI=1S/C10H17N3O/c1-2-3-4-5-8-14-10-7-6-9(11)12-13-10/h6-7H,2-5,8H2,1H3,(H2,11,12)
InChIKeyJAXRUELLOZOCKU-UHFFFAOYSA-N
MW195.27 g/mol
LogP2.02
Rot. Bonds6

About 6-hexoxypyridazin-3-amine

6-hexoxypyridazin-3-amine (PubChem CID 11959089) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 6-hexoxypyridazin-3-amine.

Molecular Properties

Compound Name6-hexoxypyridazin-3-amine
PubChem CID11959089
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name6-hexoxypyridazin-3-amine
SMILESCCCCCCOc1ccc(N)nn1
InChIInChI=1S/C10H17N3O/c1-2-3-4-5-8-14-10-7-6-9(11)12-13-10/h6-7H,2-5,8H2,1H3,(H2,11,12)
InChIKeyJAXRUELLOZOCKU-UHFFFAOYSA-N
XLogP2.02
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(chloromethyl)-6-octoxypyridazine
CID 61269519
6-(3-methylbutoxy)pyridazin-3-amine
CID 112693082
N-[(6-octoxypyridazin-3-yl)methyl]propan-2-amine
CID 62290047
5-octoxypyridin-2-amine
CID 43126983
3-heptoxy-6-(2-octoxyphenyl)pyridazine
CID 19909321
3-pentoxy-6-phenylpyridazine
CID 19760650
6-hexoxy-2-propoxypyridin-3-amine
CID 43262487
3-ethoxy-6-propoxypyridazine
CID 163526291
2-octoxyaniline
CID 14747235
3-decoxy-8-undecoxy-4,7-phenanthroline
CID 21267174
3-nonoxy-8-octoxy-4,7-phenanthroline
CID 21267382
3-[4-[2-(4-decoxyphenyl)ethynyl]phenyl]-6-dodecoxypyridazine
CID 101460428

Frequently Asked Questions

What is the IUPAC name of 6-hexoxypyridazin-3-amine?
The IUPAC name of 6-hexoxypyridazin-3-amine (CID 11959089) is 6-hexoxypyridazin-3-amine.
What is the SMILES notation for 6-hexoxypyridazin-3-amine?
The canonical SMILES for 6-hexoxypyridazin-3-amine is CCCCCCOc1ccc(N)nn1.
What is the InChIKey of 6-hexoxypyridazin-3-amine?
The InChIKey is JAXRUELLOZOCKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-2-3-4-5-8-14-10-7-6-9(11)12-13-10/h6-7H,2-5,8H2,1H3,(H2,11,12).
What are the key properties of 6-hexoxypyridazin-3-amine?
6-hexoxypyridazin-3-amine has a molecular weight of 195.27 g/mol, XLogP of 2.02, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hexoxypyridazin-3-amine is sourced from PubChem (CID 11959089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).