(2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine

C10H12F3N3O — CID 95463966

IUPAC(2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine
SMILESCc1ccc(N2CCO[C@@H](C(F)(F)F)C2)nn1
InChIInChI=1S/C10H12F3N3O/c1-7-2-3-9(15-14-7)16-4-5-17-8(6-16)10(11,12)13/h2-3,8H,4-6H2,1H3/t8-/m1/s1
InChIKeyPDWDQTWYBHYQRE-MRVPVSSYSA-N
MW247.22 g/mol
LogP1.55
Rot. Bonds1

About (2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine

(2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine (PubChem CID 95463966) has the molecular formula C10H12F3N3O and a molecular weight of 247.22 g/mol. Its IUPAC name is (2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine.

Molecular Properties

Compound Name(2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine
PubChem CID95463966
Molecular FormulaC10H12F3N3O
Molecular Weight247.22 g/mol
Exact Mass247.09
IUPAC Name(2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine
SMILESCc1ccc(N2CCO[C@@H](C(F)(F)F)C2)nn1
InChIInChI=1S/C10H12F3N3O/c1-7-2-3-9(15-14-7)16-4-5-17-8(6-16)10(11,12)13/h2-3,8H,4-6H2,1H3/t8-/m1/s1
InChIKeyPDWDQTWYBHYQRE-MRVPVSSYSA-N
XLogP1.55
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.22
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyridine-3-carboxamide
CID 154209947
1-[4-(6-methylpyridazin-3-yl)morpholin-2-yl]ethanamine
CID 115315932
4-(4-methylquinolin-2-yl)-2-(trifluoromethyl)morpholine
CID 56868973
4-[6-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]pyridazin-3-yl]morpholine
CID 155981001
2-[4-methyl-6-[(2R)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-yl]phenol
CID 136858370
methyl 6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyridine-3-carboxylate
CID 95543397
methyl 6-[(2R)-2-(trifluoromethyl)morpholin-4-yl]pyridine-3-carboxylate
CID 95543398
4-(6-chloroquinolin-2-yl)-2-(trifluoromethyl)morpholine
CID 56877497
(2S)-4-(2-methylquinolin-4-yl)-2-(trifluoromethyl)morpholine
CID 95556392
piperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone
CID 70776837
3-methyl-6-(3-methylpiperazin-1-yl)pyridazine
CID 62478379
4-methyl-7-(6-methylpyridazin-3-yl)-2,3,4a,5,6,8,9,9a-octahydro-[1,4]oxazino[2,3-d]azepine
CID 131640274

Frequently Asked Questions

What is the IUPAC name of (2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine?
The IUPAC name of (2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine (CID 95463966) is (2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine.
What is the SMILES notation for (2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine?
The canonical SMILES for (2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine is Cc1ccc(N2CCO[C@@H](C(F)(F)F)C2)nn1.
What is the InChIKey of (2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine?
The InChIKey is PDWDQTWYBHYQRE-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H12F3N3O/c1-7-2-3-9(15-14-7)16-4-5-17-8(6-16)10(11,12)13/h2-3,8H,4-6H2,1H3/t8-/m1/s1.
What are the key properties of (2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine?
(2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine has a molecular weight of 247.22 g/mol, XLogP of 1.55, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-(6-methylpyridazin-3-yl)-2-(trifluoromethyl)morpholine is sourced from PubChem (CID 95463966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).