4-bromo-6-(2-methoxyethyl)pyridazin-3-amine

C7H10BrN3O — CID 117104983

IUPAC4-bromo-6-(2-methoxyethyl)pyridazin-3-amine
SMILESCOCCc1cc(Br)c(N)nn1
InChIInChI=1S/C7H10BrN3O/c1-12-3-2-5-4-6(8)7(9)11-10-5/h4H,2-3H2,1H3,(H2,9,11)
InChIKeyFXFYYPCTVWQBIZ-UHFFFAOYSA-N
MW232.08 g/mol
LogP1.01
Rot. Bonds3

About 4-bromo-6-(2-methoxyethyl)pyridazin-3-amine

4-bromo-6-(2-methoxyethyl)pyridazin-3-amine (PubChem CID 117104983) has the molecular formula C7H10BrN3O and a molecular weight of 232.08 g/mol. Its IUPAC name is 4-bromo-6-(2-methoxyethyl)pyridazin-3-amine.

Molecular Properties

Compound Name4-bromo-6-(2-methoxyethyl)pyridazin-3-amine
PubChem CID117104983
Molecular FormulaC7H10BrN3O
Molecular Weight232.08 g/mol
Exact Mass231.00
IUPAC Name4-bromo-6-(2-methoxyethyl)pyridazin-3-amine
SMILESCOCCc1cc(Br)c(N)nn1
InChIInChI=1S/C7H10BrN3O/c1-12-3-2-5-4-6(8)7(9)11-10-5/h4H,2-3H2,1H3,(H2,9,11)
InChIKeyFXFYYPCTVWQBIZ-UHFFFAOYSA-N
XLogP1.01
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.08
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-Bromo-6-methylpyridazin-3-amine
CID 53302235
6-(2-Ethoxyethyl)pyridazin-3-amine
CID 68296159
6-(Oxetan-3-yl)pyridazin-3-amine
CID 168991422
(6-Amino-5-bromopyridazin-3-yl)methanol
CID 117104943
4-Bromo-6-(methoxymethyl)pyridazin-3-amine
CID 117104947
2-(6-Aminopyridazin-3-yl)ethanol
CID 117104957
6-(2-Methoxyethyl)pyridazin-3-amine
CID 117104960
4-Chloro-6-(2-methoxyethyl)pyridazin-3-amine
CID 117104976
2-(6-Amino-5-bromopyridazin-3-yl)ethanol
CID 117104979
5-Bromo-3-(2-methoxyethyl)pyridazine
CID 117104982
4-Bromo-3-chloro-6-(2-methoxyethyl)pyridazine
CID 117104985
4-Bromo-6-(oxolan-3-yl)pyridazin-3-amine
CID 117105003

Frequently Asked Questions

What is the IUPAC name of 4-bromo-6-(2-methoxyethyl)pyridazin-3-amine?
The IUPAC name of 4-bromo-6-(2-methoxyethyl)pyridazin-3-amine (CID 117104983) is 4-bromo-6-(2-methoxyethyl)pyridazin-3-amine.
What is the SMILES notation for 4-bromo-6-(2-methoxyethyl)pyridazin-3-amine?
The canonical SMILES for 4-bromo-6-(2-methoxyethyl)pyridazin-3-amine is COCCc1cc(Br)c(N)nn1.
What is the InChIKey of 4-bromo-6-(2-methoxyethyl)pyridazin-3-amine?
The InChIKey is FXFYYPCTVWQBIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10BrN3O/c1-12-3-2-5-4-6(8)7(9)11-10-5/h4H,2-3H2,1H3,(H2,9,11).
What are the key properties of 4-bromo-6-(2-methoxyethyl)pyridazin-3-amine?
4-bromo-6-(2-methoxyethyl)pyridazin-3-amine has a molecular weight of 232.08 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-6-(2-methoxyethyl)pyridazin-3-amine is sourced from PubChem (CID 117104983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).