4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine

C10H14ClN3O — CID 114478121

IUPAC4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine
SMILESCC1(C)CN(c2cnnc(Cl)c2)CCO1
InChIInChI=1S/C10H14ClN3O/c1-10(2)7-14(3-4-15-10)8-5-9(11)13-12-6-8/h5-6H,3-4,7H2,1-2H3
InChIKeyZXOAHQFEGSITBU-UHFFFAOYSA-N
MW227.69 g/mol
LogP1.75
Rot. Bonds1

About 4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine

4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine (PubChem CID 114478121) has the molecular formula C10H14ClN3O and a molecular weight of 227.69 g/mol. Its IUPAC name is 4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine.

Molecular Properties

Compound Name4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine
PubChem CID114478121
Molecular FormulaC10H14ClN3O
Molecular Weight227.69 g/mol
Exact Mass227.08
IUPAC Name4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine
SMILESCC1(C)CN(c2cnnc(Cl)c2)CCO1
InChIInChI=1S/C10H14ClN3O/c1-10(2)7-14(3-4-15-10)8-5-9(11)13-12-6-8/h5-6H,3-4,7H2,1-2H3
InChIKeyZXOAHQFEGSITBU-UHFFFAOYSA-N
XLogP1.75
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.69
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(6-chloropyridazin-3-yl)-2,2-dimethylmorpholine
CID 43593162
4-(5-chloropyrazin-2-yl)-2,2-dimethylmorpholine
CID 130792525
2-(3-aminopropyl)-5-(2,2-dimethylmorpholin-4-yl)pyridazin-3-one
CID 114393782
4-(2,2-dimethylmorpholin-4-yl)pyridine-2-carboxamide
CID 133313842
2,2-dimethyl-4-phenylmorpholine
CID 15576765
3-[4-(2,2-dimethylmorpholin-4-yl)-6-oxopyridazin-1-yl]-2-methylpropanethioamide
CID 114395846
2-(2-amino-3-methoxypropyl)-5-(2,2-dimethylmorpholin-4-yl)pyridazin-3-one
CID 107506459
2-amino-5-(2,2-dimethylmorpholin-4-yl)benzamide
CID 55133406
4-(2,5-dichloropyrimidin-4-yl)-2,2-dimethylmorpholine
CID 79632898
2-[2-(aminomethyl)prop-2-enyl]-5-(2,2-dimethylmorpholin-4-yl)pyridazin-3-one
CID 103073097
4-(2,2-dimethylmorpholin-4-yl)-2-methoxyaniline
CID 63669991
4-(2-chloro-5-methylpyrimidin-4-yl)-2,2-dimethylmorpholine
CID 79075234

Frequently Asked Questions

What is the IUPAC name of 4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine?
The IUPAC name of 4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine (CID 114478121) is 4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine.
What is the SMILES notation for 4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine?
The canonical SMILES for 4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine is CC1(C)CN(c2cnnc(Cl)c2)CCO1.
What is the InChIKey of 4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine?
The InChIKey is ZXOAHQFEGSITBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O/c1-10(2)7-14(3-4-15-10)8-5-9(11)13-12-6-8/h5-6H,3-4,7H2,1-2H3.
What are the key properties of 4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine?
4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine has a molecular weight of 227.69 g/mol, XLogP of 1.75, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-chloropyridazin-4-yl)-2,2-dimethylmorpholine is sourced from PubChem (CID 114478121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).