2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine

C14H25N3O2 — CID 63685497

IUPAC2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine
SMILESCCCOCCOc1ccc(CNC(C)(C)C)nn1
InChIInChI=1S/C14H25N3O2/c1-5-8-18-9-10-19-13-7-6-12(16-17-13)11-15-14(2,3)4/h6-7,15H,5,8-11H2,1-4H3
InChIKeyOUMUCJVLNSCXNY-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.17
Rot. Bonds8

About 2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine

2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine (PubChem CID 63685497) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine
PubChem CID63685497
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine
SMILESCCCOCCOc1ccc(CNC(C)(C)C)nn1
InChIInChI=1S/C14H25N3O2/c1-5-8-18-9-10-19-13-7-6-12(16-17-13)11-15-14(2,3)4/h6-7,15H,5,8-11H2,1-4H3
InChIKeyOUMUCJVLNSCXNY-UHFFFAOYSA-N
XLogP2.17
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine
CID 63684783
[6-(2-propoxyethoxy)pyridazin-3-yl]methanol
CID 63684568
N-[[6-(2-butoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine
CID 55058292
N-[[5-(2-butoxyethoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
CID 107381495
[6-(2-ethoxyethoxy)pyridazin-3-yl]methanamine
CID 62291203
2-methyl-N-[(6-propoxy-2-pyridinyl)methyl]propan-2-amine
CID 62292233
N-[[6-[2-(2-methoxyethoxy)ethoxy]pyridazin-3-yl]methyl]-2-methylpropan-1-amine
CID 104566336
N-[[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]methyl]-2-methylpropan-2-amine
CID 63936367
[6-(2-ethoxyethoxy)pyridazin-3-yl]methanol
CID 61255275
2-methyl-N-[(6-methylpyridazin-3-yl)methyl]propan-2-amine
CID 130987029
N-[(6-octoxypyridazin-3-yl)methyl]propan-2-amine
CID 62290047
N-[[6-(2,4-dichlorophenoxy)pyridazin-3-yl]methyl]-2-methylpropan-2-amine
CID 62323581

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine (CID 63685497) is 2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine is CCCOCCOc1ccc(CNC(C)(C)C)nn1.
What is the InChIKey of 2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine?
The InChIKey is OUMUCJVLNSCXNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-5-8-18-9-10-19-13-7-6-12(16-17-13)11-15-14(2,3)4/h6-7,15H,5,8-11H2,1-4H3.
What are the key properties of 2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine?
2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine has a molecular weight of 267.37 g/mol, XLogP of 2.17, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[6-(2-propoxyethoxy)pyridazin-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 63685497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).