6-chloro-5-(trifluoromethyl)pyridazin-4-amine

C5H3ClF3N3 — CID 147011369

IUPAC6-chloro-5-(trifluoromethyl)pyridazin-4-amine
SMILESNc1cnnc(Cl)c1C(F)(F)F
InChIInChI=1S/C5H3ClF3N3/c6-4-3(5(7,8)9)2(10)1-11-12-4/h1H,(H2,10,12)
InChIKeyATXSUUWJJVQZMV-UHFFFAOYSA-N
MW197.55 g/mol
LogP1.73
Rot. Bonds

About 6-chloro-5-(trifluoromethyl)pyridazin-4-amine

6-chloro-5-(trifluoromethyl)pyridazin-4-amine (PubChem CID 147011369) has the molecular formula C5H3ClF3N3 and a molecular weight of 197.55 g/mol. Its IUPAC name is 6-chloro-5-(trifluoromethyl)pyridazin-4-amine.

Molecular Properties

Compound Name6-chloro-5-(trifluoromethyl)pyridazin-4-amine
PubChem CID147011369
Molecular FormulaC5H3ClF3N3
Molecular Weight197.55 g/mol
Exact Mass197.00
IUPAC Name6-chloro-5-(trifluoromethyl)pyridazin-4-amine
SMILESNc1cnnc(Cl)c1C(F)(F)F
InChIInChI=1S/C5H3ClF3N3/c6-4-3(5(7,8)9)2(10)1-11-12-4/h1H,(H2,10,12)
InChIKeyATXSUUWJJVQZMV-UHFFFAOYSA-N
XLogP1.73
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.55
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-Dichloro-1,4-dihydropyridazin-4-imine
CID 6403201
5,6-Dichloropyridazin-4-amine
CID 6403202
5-Chloropyridazin-4-amine
CID 13001063
4-Amino-3-chloro-pyridazine
CID 22987995
5-(Trifluoromethyl)pyridazin-4-amine
CID 117127362
3-Chloro-5-(trifluoromethyl)pyridazin-4-amine
CID 117127364
5-(Trifluoromethyl)pyridazin-4-amine hydrochloride
CID 170907315
3-Chloropyridazine-4,5-diamine
CID 12705218
3-Chloro-5-methylpyridazin-4-amine
CID 89611575
5,6-dichloro-N-iodopyridazin-4-amine
CID 145185635
3,5-dichloro-N-iodopyridazin-4-amine
CID 148143511
5-Amino-6-chloropyridazine-4-carbonitrile
CID 73011441

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-(trifluoromethyl)pyridazin-4-amine?
The IUPAC name of 6-chloro-5-(trifluoromethyl)pyridazin-4-amine (CID 147011369) is 6-chloro-5-(trifluoromethyl)pyridazin-4-amine.
What is the SMILES notation for 6-chloro-5-(trifluoromethyl)pyridazin-4-amine?
The canonical SMILES for 6-chloro-5-(trifluoromethyl)pyridazin-4-amine is Nc1cnnc(Cl)c1C(F)(F)F.
What is the InChIKey of 6-chloro-5-(trifluoromethyl)pyridazin-4-amine?
The InChIKey is ATXSUUWJJVQZMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3ClF3N3/c6-4-3(5(7,8)9)2(10)1-11-12-4/h1H,(H2,10,12).
What are the key properties of 6-chloro-5-(trifluoromethyl)pyridazin-4-amine?
6-chloro-5-(trifluoromethyl)pyridazin-4-amine has a molecular weight of 197.55 g/mol, XLogP of 1.73, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-(trifluoromethyl)pyridazin-4-amine is sourced from PubChem (CID 147011369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).