N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine

C16H15N3 — CID 116973158

IUPACN-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine
SMILESCNc1ccc(-c2ccc3cc(C)ccc3c2)nn1
InChIInChI=1S/C16H15N3/c1-11-3-4-13-10-14(6-5-12(13)9-11)15-7-8-16(17-2)19-18-15/h3-10H,1-2H3,(H,17,19)
InChIKeyQTGGFSPAUPTQCN-UHFFFAOYSA-N
MW249.32 g/mol
LogP3.65
Rot. Bonds2

About N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine

N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine (PubChem CID 116973158) has the molecular formula C16H15N3 and a molecular weight of 249.32 g/mol. Its IUPAC name is N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine.

Molecular Properties

Compound NameN-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine
PubChem CID116973158
Molecular FormulaC16H15N3
Molecular Weight249.32 g/mol
Exact Mass249.13
IUPAC NameN-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine
SMILESCNc1ccc(-c2ccc3cc(C)ccc3c2)nn1
InChIInChI=1S/C16H15N3/c1-11-3-4-13-10-14(6-5-12(13)9-11)15-7-8-16(17-2)19-18-15/h3-10H,1-2H3,(H,17,19)
InChIKeyQTGGFSPAUPTQCN-UHFFFAOYSA-N
XLogP3.65
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine?
The IUPAC name of N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine (CID 116973158) is N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine.
What is the SMILES notation for N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine?
The canonical SMILES for N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine is CNc1ccc(-c2ccc3cc(C)ccc3c2)nn1.
What is the InChIKey of N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine?
The InChIKey is QTGGFSPAUPTQCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3/c1-11-3-4-13-10-14(6-5-12(13)9-11)15-7-8-16(17-2)19-18-15/h3-10H,1-2H3,(H,17,19).
What are the key properties of N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine?
N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine has a molecular weight of 249.32 g/mol, XLogP of 3.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine is sourced from PubChem (CID 116973158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).