(1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine

C7H8F3N3 — CID 121397172

IUPAC(1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine
SMILESC[C@@H](N)c1ccc(C(F)(F)F)nn1
InChIInChI=1S/C7H8F3N3/c1-4(11)5-2-3-6(13-12-5)7(8,9)10/h2-4H,11H2,1H3/t4-/m1/s1
InChIKeyMNWZSVNHYPXSKF-SCSAIBSYSA-N
MW191.16 g/mol
LogP1.52
Rot. Bonds1

About (1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine

(1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine (PubChem CID 121397172) has the molecular formula C7H8F3N3 and a molecular weight of 191.16 g/mol. Its IUPAC name is (1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine.

Molecular Properties

Compound Name(1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine
PubChem CID121397172
Molecular FormulaC7H8F3N3
Molecular Weight191.16 g/mol
Exact Mass191.07
IUPAC Name(1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine
SMILESC[C@@H](N)c1ccc(C(F)(F)F)nn1
InChIInChI=1S/C7H8F3N3/c1-4(11)5-2-3-6(13-12-5)7(8,9)10/h2-4H,11H2,1H3/t4-/m1/s1
InChIKeyMNWZSVNHYPXSKF-SCSAIBSYSA-N
XLogP1.52
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.16
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,6-Dimethylpyridazine
CID 527031
3,6-Bis(trifluoromethyl)pyridazine
CID 14744320
US10221162, Example 765.0
CID 122702377
3-Fluoro-6-methylpyridazine
CID 12379809
1-(Pyridazin-3-yl)ethan-1-amine
CID 69035378
(6-Methylpyridazin-3-yl)methanamine dihydrochloride
CID 91667906
1-(6-(Trifluoromethyl)pyridazin-3-yl)methanamine hydrochloride
CID 121397667
Pyridazine, 3-ethyl-6-methyl-
CID 12440085
Pyridazine, 3-methyl-6-n-propyl-
CID 85774315
3-Methyl-6-(trifluoromethyl)pyridazine
CID 20691950
3-Ethyl-6-fluoropyridazine
CID 21030397
N'-[(6-fluoropyridazin-3-yl)methyl]ethane-1,2-diamine
CID 21698027

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine?
The IUPAC name of (1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine (CID 121397172) is (1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine.
What is the SMILES notation for (1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine?
The canonical SMILES for (1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine is C[C@@H](N)c1ccc(C(F)(F)F)nn1.
What is the InChIKey of (1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine?
The InChIKey is MNWZSVNHYPXSKF-SCSAIBSYSA-N. The full InChI is InChI=1S/C7H8F3N3/c1-4(11)5-2-3-6(13-12-5)7(8,9)10/h2-4H,11H2,1H3/t4-/m1/s1.
What are the key properties of (1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine?
(1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine has a molecular weight of 191.16 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[6-(trifluoromethyl)pyridazin-3-yl]ethanamine is sourced from PubChem (CID 121397172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).