6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine

C16H19FN4O — CID 24746981

IUPAC6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine
SMILESFc1ccc(-c2ccc(NCCN3CCOCC3)nn2)cc1
InChIInChI=1S/C16H19FN4O/c17-14-3-1-13(2-4-14)15-5-6-16(20-19-15)18-7-8-21-9-11-22-12-10-21/h1-6H,7-12H2,(H,18,20)
InChIKeyGTVBRXJZWAQUEX-UHFFFAOYSA-N
MW302.35 g/mol
LogP2.03
Rot. Bonds5

About 6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine

6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine (PubChem CID 24746981) has the molecular formula C16H19FN4O and a molecular weight of 302.35 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine
PubChem CID24746981
Molecular FormulaC16H19FN4O
Molecular Weight302.35 g/mol
Exact Mass302.15
IUPAC Name6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine
SMILESFc1ccc(-c2ccc(NCCN3CCOCC3)nn2)cc1
InChIInChI=1S/C16H19FN4O/c17-14-3-1-13(2-4-14)15-5-6-16(20-19-15)18-7-8-21-9-11-22-12-10-21/h1-6H,7-12H2,(H,18,20)
InChIKeyGTVBRXJZWAQUEX-UHFFFAOYSA-N
XLogP2.03
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.35
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine?
The IUPAC name of 6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine (CID 24746981) is 6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine.
What is the SMILES notation for 6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine?
The canonical SMILES for 6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine is Fc1ccc(-c2ccc(NCCN3CCOCC3)nn2)cc1.
What is the InChIKey of 6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine?
The InChIKey is GTVBRXJZWAQUEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN4O/c17-14-3-1-13(2-4-14)15-5-6-16(20-19-15)18-7-8-21-9-11-22-12-10-21/h1-6H,7-12H2,(H,18,20).
What are the key properties of 6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine?
6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine has a molecular weight of 302.35 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine is sourced from PubChem (CID 24746981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).