N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine

C15H20N4 — CID 62289611

IUPACN-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine
SMILESCNCc1ccc(N(C)Cc2cccc(C)c2)nn1
InChIInChI=1S/C15H20N4/c1-12-5-4-6-13(9-12)11-19(3)15-8-7-14(10-16-2)17-18-15/h4-9,16H,10-11H2,1-3H3
InChIKeyNXOGZUNISNVLQU-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.14
Rot. Bonds5

About N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine

N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine (PubChem CID 62289611) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine.

Molecular Properties

Compound NameN-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine
PubChem CID62289611
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC NameN-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine
SMILESCNCc1ccc(N(C)Cc2cccc(C)c2)nn1
InChIInChI=1S/C15H20N4/c1-12-5-4-6-13(9-12)11-19(3)15-8-7-14(10-16-2)17-18-15/h4-9,16H,10-11H2,1-3H3
InChIKeyNXOGZUNISNVLQU-UHFFFAOYSA-N
XLogP2.14
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine?
The IUPAC name of N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine (CID 62289611) is N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine.
What is the SMILES notation for N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine?
The canonical SMILES for N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine is CNCc1ccc(N(C)Cc2cccc(C)c2)nn1.
What is the InChIKey of N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine?
The InChIKey is NXOGZUNISNVLQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-12-5-4-6-13(9-12)11-19(3)15-8-7-14(10-16-2)17-18-15/h4-9,16H,10-11H2,1-3H3.
What are the key properties of N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine?
N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine has a molecular weight of 256.35 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine is sourced from PubChem (CID 62289611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).