6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine

C17H14FN3O — CID 6411225

IUPAC6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine
SMILESCOc1cccc(Nc2ccc(-c3ccccc3F)nn2)c1
InChIInChI=1S/C17H14FN3O/c1-22-13-6-4-5-12(11-13)19-17-10-9-16(20-21-17)14-7-2-3-8-15(14)18/h2-11H,1H3,(H,19,21)
InChIKeyPPNBOOINIRZJFE-UHFFFAOYSA-N
MW295.32 g/mol
LogP4.03
Rot. Bonds4

About 6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine

6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine (PubChem CID 6411225) has the molecular formula C17H14FN3O and a molecular weight of 295.32 g/mol. Its IUPAC name is 6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine
PubChem CID6411225
Molecular FormulaC17H14FN3O
Molecular Weight295.32 g/mol
Exact Mass295.11
IUPAC Name6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine
SMILESCOc1cccc(Nc2ccc(-c3ccccc3F)nn2)c1
InChIInChI=1S/C17H14FN3O/c1-22-13-6-4-5-12(11-13)19-17-10-9-16(20-21-17)14-7-2-3-8-15(14)18/h2-11H,1H3,(H,19,21)
InChIKeyPPNBOOINIRZJFE-UHFFFAOYSA-N
XLogP4.03
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.32
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine?
The IUPAC name of 6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine (CID 6411225) is 6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine.
What is the SMILES notation for 6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine?
The canonical SMILES for 6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine is COc1cccc(Nc2ccc(-c3ccccc3F)nn2)c1.
What is the InChIKey of 6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine?
The InChIKey is PPNBOOINIRZJFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3O/c1-22-13-6-4-5-12(11-13)19-17-10-9-16(20-21-17)14-7-2-3-8-15(14)18/h2-11H,1H3,(H,19,21).
What are the key properties of 6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine?
6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine has a molecular weight of 295.32 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluorophenyl)-N-(3-methoxyphenyl)pyridazin-3-amine is sourced from PubChem (CID 6411225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).