morpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone

C11H15F3N2O2 — CID 114489929

IUPACmorpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone
SMILESO=C(C1CNCCO1)N1CC=C(C(F)(F)F)CC1
InChIInChI=1S/C11H15F3N2O2/c12-11(13,14)8-1-4-16(5-2-8)10(17)9-7-15-3-6-18-9/h1,9,15H,2-7H2
InChIKeyZBZOVJCOSZTGOL-UHFFFAOYSA-N
MW264.25 g/mol
LogP0.70
Rot. Bonds1

About morpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone

morpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone (PubChem CID 114489929) has the molecular formula C11H15F3N2O2 and a molecular weight of 264.25 g/mol. Its IUPAC name is morpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone.

Molecular Properties

Compound Namemorpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone
PubChem CID114489929
Molecular FormulaC11H15F3N2O2
Molecular Weight264.25 g/mol
Exact Mass264.11
IUPAC Namemorpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone
SMILESO=C(C1CNCCO1)N1CC=C(C(F)(F)F)CC1
InChIInChI=1S/C11H15F3N2O2/c12-11(13,14)8-1-4-16(5-2-8)10(17)9-7-15-3-6-18-9/h1,9,15H,2-7H2
InChIKeyZBZOVJCOSZTGOL-UHFFFAOYSA-N
XLogP0.70
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.25
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-(1,2,3,6-tetrahydropyridin-4-ylmethyl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 104954982
3-amino-2-methoxy-1-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]propan-1-one
CID 106113964
2-piperidin-4-yloxy-1-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]ethanone
CID 114489787
2-(2-aminoethoxy)-1-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]ethanone
CID 114489822
2-morpholin-2-yl-1-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]ethanone
CID 114489867
N-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide
CID 119748920
N-(1,2,3,6-tetrahydropyridin-4-ylmethyl)-2-(2,2,2-trifluoroethoxy)acetamide;hydrochloride
CID 120415986
(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone
CID 167866900
3-amino-2-methoxy-1-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)propan-1-one
CID 106113958
(5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone
CID 106313850
[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]-morpholin-2-ylmethanone
CID 113581471
(4-tert-butyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone
CID 113588342

Frequently Asked Questions

What is the IUPAC name of morpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone?
The IUPAC name of morpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone (CID 114489929) is morpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone.
What is the SMILES notation for morpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone?
The canonical SMILES for morpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone is O=C(C1CNCCO1)N1CC=C(C(F)(F)F)CC1.
What is the InChIKey of morpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone?
The InChIKey is ZBZOVJCOSZTGOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N2O2/c12-11(13,14)8-1-4-16(5-2-8)10(17)9-7-15-3-6-18-9/h1,9,15H,2-7H2.
What are the key properties of morpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone?
morpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone has a molecular weight of 264.25 g/mol, XLogP of 0.70, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone is sourced from PubChem (CID 114489929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).