6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine

C10H18N4S — CID 112665403

IUPAC6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine
SMILESCSCC(C)N(C)c1ccc(CN)nn1
InChIInChI=1S/C10H18N4S/c1-8(7-15-3)14(2)10-5-4-9(6-11)12-13-10/h4-5,8H,6-7,11H2,1-3H3
InChIKeyHQFJDGCRRAXPBH-UHFFFAOYSA-N
MW226.35 g/mol
LogP1.12
Rot. Bonds5

About 6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine

6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine (PubChem CID 112665403) has the molecular formula C10H18N4S and a molecular weight of 226.35 g/mol. Its IUPAC name is 6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine.

Molecular Properties

Compound Name6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine
PubChem CID112665403
Molecular FormulaC10H18N4S
Molecular Weight226.35 g/mol
Exact Mass226.13
IUPAC Name6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine
SMILESCSCC(C)N(C)c1ccc(CN)nn1
InChIInChI=1S/C10H18N4S/c1-8(7-15-3)14(2)10-5-4-9(6-11)12-13-10/h4-5,8H,6-7,11H2,1-3H3
InChIKeyHQFJDGCRRAXPBH-UHFFFAOYSA-N
XLogP1.12
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.35
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine?
The IUPAC name of 6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine (CID 112665403) is 6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine.
What is the SMILES notation for 6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine?
The canonical SMILES for 6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine is CSCC(C)N(C)c1ccc(CN)nn1.
What is the InChIKey of 6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine?
The InChIKey is HQFJDGCRRAXPBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4S/c1-8(7-15-3)14(2)10-5-4-9(6-11)12-13-10/h4-5,8H,6-7,11H2,1-3H3.
What are the key properties of 6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine?
6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine has a molecular weight of 226.35 g/mol, XLogP of 1.12, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridazin-3-amine is sourced from PubChem (CID 112665403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).