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

C9H6F3N5 — CID 153035251

IUPACN-pyridazin-3-yl-5-(trifluoromethyl)pyridazin-3-amine
SMILESFC(F)(F)c1cnnc(Nc2cccnn2)c1
InChIInChI=1S/C9H6F3N5/c10-9(11,12)6-4-8(17-14-5-6)15-7-2-1-3-13-16-7/h1-5H,(H,15,16,17)
InChIKeyVEPOLNZFMAZYDL-UHFFFAOYSA-N
MW241.18 g/mol
LogP2.03
Rot. Bonds2

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

N-pyridazin-3-yl-5-(trifluoromethyl)pyridazin-3-amine (PubChem CID 153035251) has the molecular formula C9H6F3N5 and a molecular weight of 241.18 g/mol. Its IUPAC name is N-pyridazin-3-yl-5-(trifluoromethyl)pyridazin-3-amine.

Molecular Properties

Compound NameN-pyridazin-3-yl-5-(trifluoromethyl)pyridazin-3-amine
PubChem CID153035251
Molecular FormulaC9H6F3N5
Molecular Weight241.18 g/mol
Exact Mass241.06
IUPAC NameN-pyridazin-3-yl-5-(trifluoromethyl)pyridazin-3-amine
SMILESFC(F)(F)c1cnnc(Nc2cccnn2)c1
InChIInChI=1S/C9H6F3N5/c10-9(11,12)6-4-8(17-14-5-6)15-7-2-1-3-13-16-7/h1-5H,(H,15,16,17)
InChIKeyVEPOLNZFMAZYDL-UHFFFAOYSA-N
XLogP2.03
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.18
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(Piperazin-1-yl)-5-(trifluoromethyl)pyridazine
CID 69039149
3-(4-Methylpiperazin-1-yl)-5-(trifluoromethyl)pyridazine
CID 70812437
3-(4-Iodopiperazin-1-yl)-5-(trifluoromethyl)pyridazine
CID 124085805
3-(4-Ethylpiperazin-1-yl)-5-(trifluoromethyl)pyridazine
CID 133054880
N-Methyl-5-(trifluoromethyl)pyridazin-3-amine
CID 133063415
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
5-(trifluoromethyl)-N-[5-(trifluoromethyl)pyridazin-3-yl]pyridazin-3-amine
CID 147243129
6-(trifluoromethyl)-N-[5-(trifluoromethyl)pyridazin-3-yl]pyridazin-3-amine
CID 148264997
N-pyrazin-2-yl-5-(trifluoromethyl)pyridazin-3-amine
CID 153337849
ethane;6-pyrrolidin-1-yl-N-[5-(trifluoromethyl)pyridazin-3-yl]pyridazin-3-amine
CID 153337869

Frequently Asked Questions

What is the IUPAC name of N-pyridazin-3-yl-5-(trifluoromethyl)pyridazin-3-amine?
The IUPAC name of N-pyridazin-3-yl-5-(trifluoromethyl)pyridazin-3-amine (CID 153035251) is N-pyridazin-3-yl-5-(trifluoromethyl)pyridazin-3-amine.
What is the SMILES notation for N-pyridazin-3-yl-5-(trifluoromethyl)pyridazin-3-amine?
The canonical SMILES for N-pyridazin-3-yl-5-(trifluoromethyl)pyridazin-3-amine is FC(F)(F)c1cnnc(Nc2cccnn2)c1.
What is the InChIKey of N-pyridazin-3-yl-5-(trifluoromethyl)pyridazin-3-amine?
The InChIKey is VEPOLNZFMAZYDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6F3N5/c10-9(11,12)6-4-8(17-14-5-6)15-7-2-1-3-13-16-7/h1-5H,(H,15,16,17).
What are the key properties of N-pyridazin-3-yl-5-(trifluoromethyl)pyridazin-3-amine?
N-pyridazin-3-yl-5-(trifluoromethyl)pyridazin-3-amine has a molecular weight of 241.18 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridazin-3-yl-5-(trifluoromethyl)pyridazin-3-amine is sourced from PubChem (CID 153035251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).