N-methyl-5-(trifluoromethyl)pyridazin-3-amine

C6H6F3N3 — CID 133063415

IUPACN-methyl-5-(trifluoromethyl)pyridazin-3-amine
SMILESCNc1cc(C(F)(F)F)cnn1
InChIInChI=1S/C6H6F3N3/c1-10-5-2-4(3-11-12-5)6(7,8)9/h2-3H,1H3,(H,10,12)
InChIKeyZTRBTHHHUWEBNI-UHFFFAOYSA-N
MW177.13 g/mol
LogP1.54
Rot. Bonds1

About N-methyl-5-(trifluoromethyl)pyridazin-3-amine

N-methyl-5-(trifluoromethyl)pyridazin-3-amine (PubChem CID 133063415) has the molecular formula C6H6F3N3 and a molecular weight of 177.13 g/mol. Its IUPAC name is N-methyl-5-(trifluoromethyl)pyridazin-3-amine.

Molecular Properties

Compound NameN-methyl-5-(trifluoromethyl)pyridazin-3-amine
PubChem CID133063415
Molecular FormulaC6H6F3N3
Molecular Weight177.13 g/mol
Exact Mass177.05
IUPAC NameN-methyl-5-(trifluoromethyl)pyridazin-3-amine
SMILESCNc1cc(C(F)(F)F)cnn1
InChIInChI=1S/C6H6F3N3/c1-10-5-2-4(3-11-12-5)6(7,8)9/h2-3H,1H3,(H,10,12)
InChIKeyZTRBTHHHUWEBNI-UHFFFAOYSA-N
XLogP1.54
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.13
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-5-(trifluoromethyl)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

3-(Methylamino)pyridazine-4-carbonitrile
CID 46848635
5-Methylpyridazin-3-amine
CID 14743344
N-methylpyridazin-3-amine
CID 19831906
4-(Trifluoromethyl)pyridazin-3-amine
CID 59636503
5-(Trifluoromethyl)pyridazin-3-amine
CID 67123099
N-ethylpyridazin-3-amine
CID 12446652
3-Butylaminopyridazine
CID 62483243
N-(3-propan-2-yloxypropyl)-5-(trifluoromethyl)pyridazin-3-amine
CID 126818890
3-Piperazin-1-yl-5-trifluoromethyl-pyridazine
CID 69039149
N-[[(4R)-3,3-difluoropiperidin-4-yl]methyl]pyridazin-3-amine
CID 134542857
N-[(3,3-difluoropiperidin-4-yl)methyl]pyridazin-3-amine
CID 134542860
N-[(3,3-difluoropiperidin-4-yl)methyl]pyridazin-3-amine;ethane
CID 142359893

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(trifluoromethyl)pyridazin-3-amine?
The IUPAC name of N-methyl-5-(trifluoromethyl)pyridazin-3-amine (CID 133063415) is N-methyl-5-(trifluoromethyl)pyridazin-3-amine.
What is the SMILES notation for N-methyl-5-(trifluoromethyl)pyridazin-3-amine?
The canonical SMILES for N-methyl-5-(trifluoromethyl)pyridazin-3-amine is CNc1cc(C(F)(F)F)cnn1.
What is the InChIKey of N-methyl-5-(trifluoromethyl)pyridazin-3-amine?
The InChIKey is ZTRBTHHHUWEBNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F3N3/c1-10-5-2-4(3-11-12-5)6(7,8)9/h2-3H,1H3,(H,10,12).
What are the key properties of N-methyl-5-(trifluoromethyl)pyridazin-3-amine?
N-methyl-5-(trifluoromethyl)pyridazin-3-amine has a molecular weight of 177.13 g/mol, XLogP of 1.54, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(trifluoromethyl)pyridazin-3-amine is sourced from PubChem (CID 133063415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).