[6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol

C6H6F3N3O — CID 170598629

IUPAC[6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol
SMILESNc1cc(C(F)(F)F)c(CO)nn1
InChIInChI=1S/C6H6F3N3O/c7-6(8,9)3-1-5(10)12-11-4(3)2-13/h1,13H,2H2,(H2,10,12)
InChIKeyMAPUGAUDTUMPSI-UHFFFAOYSA-N
MW193.13 g/mol
LogP0.57
Rot. Bonds1

About [6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol

[6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol (PubChem CID 170598629) has the molecular formula C6H6F3N3O and a molecular weight of 193.13 g/mol. Its IUPAC name is [6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol.

Molecular Properties

Compound Name[6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol
PubChem CID170598629
Molecular FormulaC6H6F3N3O
Molecular Weight193.13 g/mol
Exact Mass193.05
IUPAC Name[6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol
SMILESNc1cc(C(F)(F)F)c(CO)nn1
InChIInChI=1S/C6H6F3N3O/c7-6(8,9)3-1-5(10)12-11-4(3)2-13/h1,13H,2H2,(H2,10,12)
InChIKeyMAPUGAUDTUMPSI-UHFFFAOYSA-N
XLogP0.57
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.13
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol 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

[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]methanol
CID 84820125
[6-(aminomethyl)-5-(trifluoromethoxy)-3-(trifluoromethyl)-2-pyridinyl]methanol
CID 118831104
[2-amino-4,5-bis(trifluoromethyl)phenyl]methanol
CID 119022514
[3-(difluoromethyl)-6-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol
CID 133103764
[5-(difluoromethyl)-6-methoxy-3-(trifluoromethyl)-2-pyridinyl]methanol
CID 133099748
6-(aminomethyl)-5-(trifluoromethyl)pyridin-3-amine
CID 156681115
ethane;3-ethyl-6-methyl-4-(trifluoromethyl)pyridazine
CID 165399562
[3-amino-6-(trifluoromethyl)-2-pyridinyl]methanol
CID 53414335
[2-amino-4-(trifluoromethyl)-3-pyridinyl]methanol
CID 118704003
[6-amino-5-(trifluoromethyl)-2-pyridinyl]methanol
CID 119001294
[6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanol
CID 105444645
[5-amino-2-fluoro-3-(trifluoromethyl)phenyl]methanol
CID 131189371

Frequently Asked Questions

What is the IUPAC name of [6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol?
The IUPAC name of [6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol (CID 170598629) is [6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol.
What is the SMILES notation for [6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol?
The canonical SMILES for [6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol is Nc1cc(C(F)(F)F)c(CO)nn1.
What is the InChIKey of [6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol?
The InChIKey is MAPUGAUDTUMPSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F3N3O/c7-6(8,9)3-1-5(10)12-11-4(3)2-13/h1,13H,2H2,(H2,10,12).
What are the key properties of [6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol?
[6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol has a molecular weight of 193.13 g/mol, XLogP of 0.57, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-amino-4-(trifluoromethyl)pyridazin-3-yl]methanol is sourced from PubChem (CID 170598629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).