N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine

C11H19N3O2 — CID 63684783

IUPACN-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine
SMILESCCCOCCOc1ccc(CNC)nn1
InChIInChI=1S/C11H19N3O2/c1-3-6-15-7-8-16-11-5-4-10(9-12-2)13-14-11/h4-5,12H,3,6-9H2,1-2H3
InChIKeyPURKKCIGVNRAAB-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.00
Rot. Bonds8

About N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine

N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine (PubChem CID 63684783) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine
PubChem CID63684783
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC NameN-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine
SMILESCCCOCCOc1ccc(CNC)nn1
InChIInChI=1S/C11H19N3O2/c1-3-6-15-7-8-16-11-5-4-10(9-12-2)13-14-11/h4-5,12H,3,6-9H2,1-2H3
InChIKeyPURKKCIGVNRAAB-UHFFFAOYSA-N
XLogP1.00
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine
CID 63685497
[6-(2-propoxyethoxy)pyridazin-3-yl]methanol
CID 63684568
N-[[6-(2-butoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine
CID 55058292
1-(6-but-3-enoxypyridazin-3-yl)-N-methylmethanamine
CID 62289698
N-methyl-1-[6-(2-propoxyphenoxy)pyridazin-3-yl]methanamine
CID 62296888
N-[(6-propoxypyridazin-3-yl)methyl]propan-1-amine
CID 62291148
[6-(2-ethoxyethoxy)pyridazin-3-yl]methanamine
CID 62291203
N-[[6-[2-(2-methoxyethoxy)ethoxy]pyridazin-3-yl]methyl]-2-methylpropan-1-amine
CID 104566336
[6-(2-ethoxyethoxy)pyridazin-3-yl]methanol
CID 61255275
1-(6-butan-2-yloxypyridazin-3-yl)-N-methylmethanamine
CID 62296817
N-[(6-octoxypyridazin-3-yl)methyl]propan-2-amine
CID 62290047
3-ethoxy-6-propoxypyridazine
CID 163526291

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine?
The IUPAC name of N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine (CID 63684783) is N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine.
What is the SMILES notation for N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine?
The canonical SMILES for N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine is CCCOCCOc1ccc(CNC)nn1.
What is the InChIKey of N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine?
The InChIKey is PURKKCIGVNRAAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-3-6-15-7-8-16-11-5-4-10(9-12-2)13-14-11/h4-5,12H,3,6-9H2,1-2H3.
What are the key properties of N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine?
N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine has a molecular weight of 225.29 g/mol, XLogP of 1.00, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine is sourced from PubChem (CID 63684783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).