3-chloro-6-(3-fluorophenyl)pyridazin-4-amine

C10H7ClFN3 — CID 117127138

IUPAC3-chloro-6-(3-fluorophenyl)pyridazin-4-amine
SMILESNc1cc(-c2cccc(F)c2)nnc1Cl
InChIInChI=1S/C10H7ClFN3/c11-10-8(13)5-9(14-15-10)6-2-1-3-7(12)4-6/h1-5H,(H2,13,14)
InChIKeyXHCRQTZHMDDGSH-UHFFFAOYSA-N
MW223.64 g/mol
LogP2.52
Rot. Bonds1

About 3-chloro-6-(3-fluorophenyl)pyridazin-4-amine

3-chloro-6-(3-fluorophenyl)pyridazin-4-amine (PubChem CID 117127138) has the molecular formula C10H7ClFN3 and a molecular weight of 223.64 g/mol. Its IUPAC name is 3-chloro-6-(3-fluorophenyl)pyridazin-4-amine.

Molecular Properties

Compound Name3-chloro-6-(3-fluorophenyl)pyridazin-4-amine
PubChem CID117127138
Molecular FormulaC10H7ClFN3
Molecular Weight223.64 g/mol
Exact Mass223.03
IUPAC Name3-chloro-6-(3-fluorophenyl)pyridazin-4-amine
SMILESNc1cc(-c2cccc(F)c2)nnc1Cl
InChIInChI=1S/C10H7ClFN3/c11-10-8(13)5-9(14-15-10)6-2-1-3-7(12)4-6/h1-5H,(H2,13,14)
InChIKeyXHCRQTZHMDDGSH-UHFFFAOYSA-N
XLogP2.52
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.64
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-Chloro-6-phenylpyridazine
CID 88515
3-Benzyl-6-chloropyridazine
CID 6404535
3-Chloro-6-[3-(trifluoromethyl)phenyl]pyridazine
CID 12449552
3-Chloro-6-(4-fluorophenyl)pyridazine
CID 6422444
3-Chloro-6-(2-fluorobenzyl)pyridazine
CID 6404571
6-Chloro-4-methyl-3-phenylpyridazine
CID 6409790
3-(4-Chlorophenyl)-4,6-dichloropyridazine
CID 6991938
3-Chloro-6-(2-chlorophenyl)pyridazine
CID 12449557
6-Chloro-3-methyl-4-phenylpyridazine
CID 13735309
6-Chloro-4-ethyl-3-phenylpyridazine
CID 14700601
3-Chloro-6-(3-fluorophenyl)-4-methylpyridazine
CID 54595715
2-(6-Chloropyridazin-3-yl)-2-(2-fluorophenyl)acetonitrile
CID 5708409

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(3-fluorophenyl)pyridazin-4-amine?
The IUPAC name of 3-chloro-6-(3-fluorophenyl)pyridazin-4-amine (CID 117127138) is 3-chloro-6-(3-fluorophenyl)pyridazin-4-amine.
What is the SMILES notation for 3-chloro-6-(3-fluorophenyl)pyridazin-4-amine?
The canonical SMILES for 3-chloro-6-(3-fluorophenyl)pyridazin-4-amine is Nc1cc(-c2cccc(F)c2)nnc1Cl.
What is the InChIKey of 3-chloro-6-(3-fluorophenyl)pyridazin-4-amine?
The InChIKey is XHCRQTZHMDDGSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClFN3/c11-10-8(13)5-9(14-15-10)6-2-1-3-7(12)4-6/h1-5H,(H2,13,14).
What are the key properties of 3-chloro-6-(3-fluorophenyl)pyridazin-4-amine?
3-chloro-6-(3-fluorophenyl)pyridazin-4-amine has a molecular weight of 223.64 g/mol, XLogP of 2.52, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-(3-fluorophenyl)pyridazin-4-amine is sourced from PubChem (CID 117127138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).