[6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine

C11H19N3O3 — CID 103405953

IUPAC[6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine
SMILESCOCCOCCCOc1ccc(CN)nn1
InChIInChI=1S/C11H19N3O3/c1-15-7-8-16-5-2-6-17-11-4-3-10(9-12)13-14-11/h3-4H,2,5-9,12H2,1H3
InChIKeyRSJIMDNKLSLRMD-UHFFFAOYSA-N
MW241.29 g/mol
LogP0.37
Rot. Bonds9

About [6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine

[6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine (PubChem CID 103405953) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is [6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine.

Molecular Properties

Compound Name[6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine
PubChem CID103405953
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name[6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine
SMILESCOCCOCCCOc1ccc(CN)nn1
InChIInChI=1S/C11H19N3O3/c1-15-7-8-16-5-2-6-17-11-4-3-10(9-12)13-14-11/h3-4H,2,5-9,12H2,1H3
InChIKeyRSJIMDNKLSLRMD-UHFFFAOYSA-N
XLogP0.37
TPSA79.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[6-(2-ethoxyethoxy)pyridazin-3-yl]methanamine
CID 62291203
[3-chloro-6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methanamine
CID 103405839
N-[[6-[2-(2-methoxyethoxy)ethoxy]pyridazin-3-yl]methyl]-2-methylpropan-1-amine
CID 104566336
[6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine
CID 103180853
6-[2-(3-methoxypropoxy)ethoxy]pyridin-3-amine
CID 103176771
[6-[3-(2-methoxyethoxy)propoxymethyl]-2-pyridinyl]methanamine
CID 106908742
[6-(2-methylpropoxy)pyridazin-3-yl]methanamine
CID 62292495
[6-(2-propoxyethoxy)pyridazin-3-yl]methanol
CID 63684568
N-[[6-(2-butoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine
CID 55058292
[2-bromo-6-[3-(2-methoxyethoxy)propoxy]phenyl]methanamine
CID 103400825
[3-chloro-6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methanol
CID 103403961
3-chloro-6-[2-(3-methoxypropoxy)ethoxymethyl]pyridazine
CID 103177400

Frequently Asked Questions

What is the IUPAC name of [6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine?
The IUPAC name of [6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine (CID 103405953) is [6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine.
What is the SMILES notation for [6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine?
The canonical SMILES for [6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine is COCCOCCCOc1ccc(CN)nn1.
What is the InChIKey of [6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine?
The InChIKey is RSJIMDNKLSLRMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-15-7-8-16-5-2-6-17-11-4-3-10(9-12)13-14-11/h3-4H,2,5-9,12H2,1H3.
What are the key properties of [6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine?
[6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine has a molecular weight of 241.29 g/mol, XLogP of 0.37, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine is sourced from PubChem (CID 103405953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).