4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine

C11H8F3N3 — CID 143047757

IUPAC4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine
SMILESNc1nnccc1-c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C11H8F3N3/c12-11(13,14)8-3-1-7(2-4-8)9-5-6-16-17-10(9)15/h1-6H,(H2,15,17)
InChIKeyHIOUMUJYSRPUJI-UHFFFAOYSA-N
MW239.20 g/mol
LogP2.74
Rot. Bonds1

About 4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine

4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine (PubChem CID 143047757) has the molecular formula C11H8F3N3 and a molecular weight of 239.20 g/mol. Its IUPAC name is 4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine.

Molecular Properties

Compound Name4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine
PubChem CID143047757
Molecular FormulaC11H8F3N3
Molecular Weight239.20 g/mol
Exact Mass239.07
IUPAC Name4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine
SMILESNc1nnccc1-c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C11H8F3N3/c12-11(13,14)8-3-1-7(2-4-8)9-5-6-16-17-10(9)15/h1-6H,(H2,15,17)
InChIKeyHIOUMUJYSRPUJI-UHFFFAOYSA-N
XLogP2.74
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.20
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
CID 10610924
3-(trifluoromethyl)-4-[4-(trifluoromethyl)phenyl]pyridine
CID 174650636
4-[4-(trifluoromethyl)phenyl]pyridine-3-carbaldehyde
CID 82382595
[2-amino-3-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol
CID 134618432
5-(trifluoromethyl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-amine
CID 119003597
2-fluoro-3-[4-(trifluoromethyl)phenyl]aniline
CID 134624111
6-amino-5-[4-(trifluoromethyl)phenyl]pyridine-3-carbaldehyde
CID 87405942
4-amino-2-methyl-5-[4-(trifluoromethyl)phenyl]pyridazin-3-one
CID 117127653
3-[4-(trifluoromethyl)phenyl]quinoxalin-2-amine
CID 91442502
2-[4-(trifluoromethyl)phenyl]pyrimidine
CID 15486309
5-amino-2-[4-(trifluoromethyl)phenyl]benzamide
CID 68829793
3-amino-6-[4-(trifluoromethyl)phenyl]-1H-pyrazin-2-one
CID 178183729

Frequently Asked Questions

What is the IUPAC name of 4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine?
The IUPAC name of 4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine (CID 143047757) is 4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine.
What is the SMILES notation for 4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine?
The canonical SMILES for 4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine is Nc1nnccc1-c1ccc(C(F)(F)F)cc1.
What is the InChIKey of 4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine?
The InChIKey is HIOUMUJYSRPUJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F3N3/c12-11(13,14)8-3-1-7(2-4-8)9-5-6-16-17-10(9)15/h1-6H,(H2,15,17).
What are the key properties of 4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine?
4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine has a molecular weight of 239.20 g/mol, XLogP of 2.74, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(trifluoromethyl)phenyl]pyridazin-3-amine is sourced from PubChem (CID 143047757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).