2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine

C12H19N3O — CID 103374137

IUPAC2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine
SMILESCNC(CC1CCC1)c1ccc(OC)nn1
InChIInChI=1S/C12H19N3O/c1-13-11(8-9-4-3-5-9)10-6-7-12(16-2)15-14-10/h6-7,9,11,13H,3-5,8H2,1-2H3
InChIKeyUJUJQFNZGPJLSF-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.94
Rot. Bonds5

About 2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine

2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine (PubChem CID 103374137) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine
PubChem CID103374137
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine
SMILESCNC(CC1CCC1)c1ccc(OC)nn1
InChIInChI=1S/C12H19N3O/c1-13-11(8-9-4-3-5-9)10-6-7-12(16-2)15-14-10/h6-7,9,11,13H,3-5,8H2,1-2H3
InChIKeyUJUJQFNZGPJLSF-UHFFFAOYSA-N
XLogP1.94
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-cyclobutyl-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine
CID 103375704
2-cyclopentyl-1-(6-methoxypyrimidin-4-yl)-N-methylethanamine
CID 102950983
2-cyclopropyl-1-(6-methoxypyrimidin-4-yl)-N-methylethanamine
CID 102950996
2-cyclobutyl-1-(3,4-dichlorophenyl)-N-methylethanamine
CID 81491759
1-(6-methoxypyridazin-3-yl)-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
CID 103374344
[2-methoxy-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine
CID 103375615
N-[cycloheptyl-(6-methoxypyridazin-3-yl)methyl]ethanamine
CID 103374557
[(6-methoxypyridazin-3-yl)-(oxan-3-yl)methyl]hydrazine
CID 107139737
1-(3,4-dimethylcyclohexyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine
CID 103374258
2-cyclobutyl-N-ethyl-1-(4-methoxyphenyl)ethanamine
CID 65458581
1-(3-chloro-2,4-dimethoxyphenyl)-2-cyclobutyl-N-methylethanamine
CID 103163381
1-(4-cyclobutylphenyl)-2-cyclopentyl-N-methylethanamine
CID 105045068

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine?
The IUPAC name of 2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine (CID 103374137) is 2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine.
What is the SMILES notation for 2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine?
The canonical SMILES for 2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine is CNC(CC1CCC1)c1ccc(OC)nn1.
What is the InChIKey of 2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine?
The InChIKey is UJUJQFNZGPJLSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-13-11(8-9-4-3-5-9)10-6-7-12(16-2)15-14-10/h6-7,9,11,13H,3-5,8H2,1-2H3.
What are the key properties of 2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine?
2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine has a molecular weight of 221.30 g/mol, XLogP of 1.94, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-1-(6-methoxypyridazin-3-yl)-N-methylethanamine is sourced from PubChem (CID 103374137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).