6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine

C7H10ClN3O — CID 155593124

IUPAC6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine
SMILESCOCc1c(N)nnc(Cl)c1C
InChIInChI=1S/C7H10ClN3O/c1-4-5(3-12-2)7(9)11-10-6(4)8/h3H2,1-2H3,(H2,9,11)
InChIKeyDXQOJEALSQWZGK-UHFFFAOYSA-N
MW187.63 g/mol
LogP1.17
Rot. Bonds2

About 6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine

6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine (PubChem CID 155593124) has the molecular formula C7H10ClN3O and a molecular weight of 187.63 g/mol. Its IUPAC name is 6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine
PubChem CID155593124
Molecular FormulaC7H10ClN3O
Molecular Weight187.63 g/mol
Exact Mass187.05
IUPAC Name6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine
SMILESCOCc1c(N)nnc(Cl)c1C
InChIInChI=1S/C7H10ClN3O/c1-4-5(3-12-2)7(9)11-10-6(4)8/h3H2,1-2H3,(H2,9,11)
InChIKeyDXQOJEALSQWZGK-UHFFFAOYSA-N
XLogP1.17
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.63
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine?
The IUPAC name of 6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine (CID 155593124) is 6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine.
What is the SMILES notation for 6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine?
The canonical SMILES for 6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine is COCc1c(N)nnc(Cl)c1C.
What is the InChIKey of 6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine?
The InChIKey is DXQOJEALSQWZGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN3O/c1-4-5(3-12-2)7(9)11-10-6(4)8/h3H2,1-2H3,(H2,9,11).
What are the key properties of 6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine?
6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine has a molecular weight of 187.63 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4-(methoxymethyl)-5-methylpyridazin-3-amine is sourced from PubChem (CID 155593124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).