6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine

C13H16N4 — CID 62286544

IUPAC6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine
SMILESCc1ccccc1N(C)c1ccc(CN)nn1
InChIInChI=1S/C13H16N4/c1-10-5-3-4-6-12(10)17(2)13-8-7-11(9-14)15-16-13/h3-8H,9,14H2,1-2H3
InChIKeyVAWCQAZVGPAJSM-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.01
Rot. Bonds3

About 6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine

6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine (PubChem CID 62286544) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is 6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine
PubChem CID62286544
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC Name6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine
SMILESCc1ccccc1N(C)c1ccc(CN)nn1
InChIInChI=1S/C13H16N4/c1-10-5-3-4-6-12(10)17(2)13-8-7-11(9-14)15-16-13/h3-8H,9,14H2,1-2H3
InChIKeyVAWCQAZVGPAJSM-UHFFFAOYSA-N
XLogP2.01
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine?
The IUPAC name of 6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine (CID 62286544) is 6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine.
What is the SMILES notation for 6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine?
The canonical SMILES for 6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine is Cc1ccccc1N(C)c1ccc(CN)nn1.
What is the InChIKey of 6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine?
The InChIKey is VAWCQAZVGPAJSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-10-5-3-4-6-12(10)17(2)13-8-7-11(9-14)15-16-13/h3-8H,9,14H2,1-2H3.
What are the key properties of 6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine?
6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine has a molecular weight of 228.30 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridazin-3-amine is sourced from PubChem (CID 62286544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).