1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine

C13H14FN3O — CID 63936765

IUPAC1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine
SMILESCNCc1ccc(OCc2ccccc2F)nn1
InChIInChI=1S/C13H14FN3O/c1-15-8-11-6-7-13(17-16-11)18-9-10-4-2-3-5-12(10)14/h2-7,15H,8-9H2,1H3
InChIKeySDSMQNYPIWNQCJ-UHFFFAOYSA-N
MW247.27 g/mol
LogP1.91
Rot. Bonds5

About 1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine

1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine (PubChem CID 63936765) has the molecular formula C13H14FN3O and a molecular weight of 247.27 g/mol. Its IUPAC name is 1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine
PubChem CID63936765
Molecular FormulaC13H14FN3O
Molecular Weight247.27 g/mol
Exact Mass247.11
IUPAC Name1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine
SMILESCNCc1ccc(OCc2ccccc2F)nn1
InChIInChI=1S/C13H14FN3O/c1-15-8-11-6-7-13(17-16-11)18-9-10-4-2-3-5-12(10)14/h2-7,15H,8-9H2,1H3
InChIKeySDSMQNYPIWNQCJ-UHFFFAOYSA-N
XLogP1.91
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.27
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]methyl]-2-methylpropan-2-amine
CID 63936367
1-[5-[(2-fluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
CID 79776321
N-[[6-[(2-bromophenyl)methoxy]pyridazin-3-yl]methyl]ethanamine
CID 82831544
1-[4-[(2-fluorophenyl)methoxy]-3-pyridinyl]-N-methylmethanamine
CID 81251244
4-[(2-fluorophenyl)methoxy]-N-methylpyrimidin-2-amine
CID 80876879
N-methyl-1-[6-(2-propoxyethoxy)pyridazin-3-yl]methanamine
CID 63684783
N-methyl-1-[6-(2-propoxyphenoxy)pyridazin-3-yl]methanamine
CID 62296888
N-[[2-[(2-fluorophenyl)methoxy]-4-pyridinyl]methyl]propan-2-amine
CID 63937965
N-[[6-(2-fluorophenoxy)pyridazin-3-yl]methyl]propan-2-amine
CID 62295895
1-[1-(1-cyclohexylethyl)-5-[(2-fluorophenyl)methoxy]pyrazol-3-yl]-N-methylmethanamine
CID 66665530
1-[6-[(2-fluorophenoxy)methyl]-2-pyridinyl]-N-methylmethanamine
CID 106907979
1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine
CID 62295663

Frequently Asked Questions

What is the IUPAC name of 1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine (CID 63936765) is 1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine is CNCc1ccc(OCc2ccccc2F)nn1.
What is the InChIKey of 1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine?
The InChIKey is SDSMQNYPIWNQCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FN3O/c1-15-8-11-6-7-13(17-16-11)18-9-10-4-2-3-5-12(10)14/h2-7,15H,8-9H2,1H3.
What are the key properties of 1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine?
1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine has a molecular weight of 247.27 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine is sourced from PubChem (CID 63936765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).