N-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine

C16H19N3O — CID 62291976

IUPACN-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine
SMILESCNCc1ccc(OC2CCCc3ccccc32)nn1
InChIInChI=1S/C16H19N3O/c1-17-11-13-9-10-16(19-18-13)20-15-8-4-6-12-5-2-3-7-14(12)15/h2-3,5,7,9-10,15,17H,4,6,8,11H2,1H3
InChIKeyCARJSSQUYGXDKI-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.65
Rot. Bonds4

About N-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine

N-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine (PubChem CID 62291976) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine
PubChem CID62291976
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine
SMILESCNCc1ccc(OC2CCCc3ccccc32)nn1
InChIInChI=1S/C16H19N3O/c1-17-11-13-9-10-16(19-18-13)20-15-8-4-6-12-5-2-3-7-14(12)15/h2-3,5,7,9-10,15,17H,4,6,8,11H2,1H3
InChIKeyCARJSSQUYGXDKI-UHFFFAOYSA-N
XLogP2.65
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine?
The IUPAC name of N-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine (CID 62291976) is N-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine.
What is the SMILES notation for N-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine?
The canonical SMILES for N-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine is CNCc1ccc(OC2CCCc3ccccc32)nn1.
What is the InChIKey of N-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine?
The InChIKey is CARJSSQUYGXDKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-17-11-13-9-10-16(19-18-13)20-15-8-4-6-12-5-2-3-7-14(12)15/h2-3,5,7,9-10,15,17H,4,6,8,11H2,1H3.
What are the key properties of N-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine?
N-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine has a molecular weight of 269.35 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridazin-3-yl]methanamine is sourced from PubChem (CID 62291976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).