6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine

C11H7ClF3N3O — CID 43151729

IUPAC6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine
SMILESFC(F)(F)Oc1cccc(Nc2ccc(Cl)nn2)c1
InChIInChI=1S/C11H7ClF3N3O/c12-9-4-5-10(18-17-9)16-7-2-1-3-8(6-7)19-11(13,14)15/h1-6H,(H,16,18)
InChIKeyXQMKYVKSUWGQDC-UHFFFAOYSA-N
MW289.64 g/mol
LogP3.77
Rot. Bonds3

About 6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine

6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine (PubChem CID 43151729) has the molecular formula C11H7ClF3N3O and a molecular weight of 289.64 g/mol. Its IUPAC name is 6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine
PubChem CID43151729
Molecular FormulaC11H7ClF3N3O
Molecular Weight289.64 g/mol
Exact Mass289.02
IUPAC Name6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine
SMILESFC(F)(F)Oc1cccc(Nc2ccc(Cl)nn2)c1
InChIInChI=1S/C11H7ClF3N3O/c12-9-4-5-10(18-17-9)16-7-2-1-3-8(6-7)19-11(13,14)15/h1-6H,(H,16,18)
InChIKeyXQMKYVKSUWGQDC-UHFFFAOYSA-N
XLogP3.77
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.64
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-chloro-N-(3-iodophenyl)pyridazin-3-amine
CID 43090226
1-N,2-N-bis[3-(trifluoromethoxy)phenyl]benzene-1,2-diamine
CID 19351987
6-N,2-dimethyl-4-N-[3-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine
CID 80729894
6-chloro-N-(3-propan-2-ylphenyl)pyridazin-3-amine
CID 43090207
5-[3-(trifluoromethoxy)anilino]-1,3,4-oxadiazole-2-carbaldehyde
CID 143766470
6-chloro-5-methyl-N-[3-(trifluoromethoxy)phenyl]pyrimidin-4-amine
CID 63736450
6-chloro-N-(3,4-difluorophenyl)pyridazin-3-amine
CID 43151751
5-(2,3-difluorophenyl)-N-[3-(trifluoromethoxy)phenyl]pyridin-2-amine
CID 162637331
5-N-(3-chlorophenyl)-6-N-[3-(trifluoromethoxy)phenyl]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
CID 169155527
N-[4-[6-[3-(trifluoromethoxy)anilino]-3-pyridinyl]phenyl]acetamide
CID 68563416
4-chloro-6-[3-(trifluoromethoxy)anilino]pyrimidine-5-carbaldehyde
CID 66366312
2-chloro-N-[3-(trifluoromethoxy)phenyl]benzamide
CID 38257874

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine?
The IUPAC name of 6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine (CID 43151729) is 6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine.
What is the SMILES notation for 6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine?
The canonical SMILES for 6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine is FC(F)(F)Oc1cccc(Nc2ccc(Cl)nn2)c1.
What is the InChIKey of 6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine?
The InChIKey is XQMKYVKSUWGQDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClF3N3O/c12-9-4-5-10(18-17-9)16-7-2-1-3-8(6-7)19-11(13,14)15/h1-6H,(H,16,18).
What are the key properties of 6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine?
6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine has a molecular weight of 289.64 g/mol, XLogP of 3.77, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine is sourced from PubChem (CID 43151729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).