[3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine

C12H20N4O — CID 80507485

IUPAC[3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine
SMILESCCC1COC(C)CN1c1nnccc1CN
InChIInChI=1S/C12H20N4O/c1-3-11-8-17-9(2)7-16(11)12-10(6-13)4-5-14-15-12/h4-5,9,11H,3,6-8,13H2,1-2H3
InChIKeyVUJUNANBQHETAF-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.94
Rot. Bonds3

About [3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine

[3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine (PubChem CID 80507485) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is [3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine.

Molecular Properties

Compound Name[3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine
PubChem CID80507485
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name[3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine
SMILESCCC1COC(C)CN1c1nnccc1CN
InChIInChI=1S/C12H20N4O/c1-3-11-8-17-9(2)7-16(11)12-10(6-13)4-5-14-15-12/h4-5,9,11H,3,6-8,13H2,1-2H3
InChIKeyVUJUNANBQHETAF-UHFFFAOYSA-N
XLogP0.94
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-(5-ethyl-2-methylmorpholin-4-yl)phenyl]methanamine
CID 43572805
1-[2-(5-ethyl-2-methylmorpholin-4-yl)-3-pyridinyl]-N-methylmethanamine
CID 62287071
4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine
CID 80795705
N-[[2-(5-ethyl-2-methylmorpholin-4-yl)-3-fluoro-4-pyridinyl]methyl]propan-1-amine
CID 105389592
[4-(5-ethyl-2-methylmorpholin-4-yl)-2,6-dimethyl-3-pyridinyl]methanamine
CID 81051008
[3-(2,5-dimethylpiperidin-1-yl)pyridazin-4-yl]methanamine
CID 80509071
6-(5-ethyl-2-methylmorpholin-4-yl)pyridin-2-amine
CID 80653171
[4-(5-ethyl-2-methylmorpholin-4-yl)-3-methylphenyl]methanamine
CID 60929563
3,5-dichloro-6-(5-ethyl-2-methylmorpholin-4-yl)pyridin-2-amine
CID 102756606
2-(5-ethyl-2-methylmorpholin-4-yl)-3-methylaniline
CID 113333692
[4-(5-ethyl-2-methylmorpholin-4-yl)-3,5-difluorophenyl]methanamine
CID 63078187
[6-(5-ethyl-2-methylmorpholin-4-yl)-5-methylpyrimidin-4-yl]hydrazine
CID 80896083

Frequently Asked Questions

What is the IUPAC name of [3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine?
The IUPAC name of [3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine (CID 80507485) is [3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine.
What is the SMILES notation for [3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine?
The canonical SMILES for [3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine is CCC1COC(C)CN1c1nnccc1CN.
What is the InChIKey of [3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine?
The InChIKey is VUJUNANBQHETAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-3-11-8-17-9(2)7-16(11)12-10(6-13)4-5-14-15-12/h4-5,9,11H,3,6-8,13H2,1-2H3.
What are the key properties of [3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine?
[3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine has a molecular weight of 236.32 g/mol, XLogP of 0.94, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(5-ethyl-2-methylmorpholin-4-yl)pyridazin-4-yl]methanamine is sourced from PubChem (CID 80507485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).