5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine

C8H13N3O — CID 62785157

IUPAC5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine
SMILESCNc1cc(COC)c(C)nn1
InChIInChI=1S/C8H13N3O/c1-6-7(5-12-3)4-8(9-2)11-10-6/h4H,5H2,1-3H3,(H,9,11)
InChIKeyKCILUTGMJHKZCU-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.97
Rot. Bonds3

About 5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine

5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine (PubChem CID 62785157) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine.

Molecular Properties

Compound Name5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine
PubChem CID62785157
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine
SMILESCNc1cc(COC)c(C)nn1
InChIInChI=1S/C8H13N3O/c1-6-7(5-12-3)4-8(9-2)11-10-6/h4H,5H2,1-3H3,(H,9,11)
InChIKeyKCILUTGMJHKZCU-UHFFFAOYSA-N
XLogP0.97
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine?
The IUPAC name of 5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine (CID 62785157) is 5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine.
What is the SMILES notation for 5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine?
The canonical SMILES for 5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine is CNc1cc(COC)c(C)nn1.
What is the InChIKey of 5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine?
The InChIKey is KCILUTGMJHKZCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-6-7(5-12-3)4-8(9-2)11-10-6/h4H,5H2,1-3H3,(H,9,11).
What are the key properties of 5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine?
5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine has a molecular weight of 167.21 g/mol, XLogP of 0.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-N,6-dimethylpyridazin-3-amine is sourced from PubChem (CID 62785157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).