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Piperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone

C16H20F3N3O2 — CID 70776837

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPACpiperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone
SMILESO=C(c1ccc(N2CCOC(C(F)(F)F)C2)nc1)N1CCCCC1
InChIInChI=1S/C16H20F3N3O2/c17-16(18,19)13-11-22(8-9-24-13)14-5-4-12(10-20-14)15(23)21-6-2-1-3-7-21/h4-5,10,13H,1-3,6-9,11H2
InChIKeyOSGSMUCDMAFWPJ-UHFFFAOYSA-N
MW343.35 g/mol
LogP2.48
Rot. Bonds2

About Piperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone

Piperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone (PubChem CID 70776837) has the molecular formula C16H20F3N3O2 and a molecular weight of 343.35 g/mol. Its IUPAC name is piperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone.

Molecular Properties

Compound NamePiperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone
PubChem CID70776837
Molecular FormulaC16H20F3N3O2
Molecular Weight343.35 g/mol
Exact Mass343.15
IUPAC Namepiperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone
SMILESO=C(c1ccc(N2CCOC(C(F)(F)F)C2)nc1)N1CCCCC1
InChIInChI=1S/C16H20F3N3O2/c17-16(18,19)13-11-22(8-9-24-13)14-5-4-12(10-20-14)15(23)21-6-2-1-3-7-21/h4-5,10,13H,1-3,6-9,11H2
InChIKeyOSGSMUCDMAFWPJ-UHFFFAOYSA-N
XLogP2.48
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.35
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of Piperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone?
The IUPAC name of Piperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone (CID 70776837) is piperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone.
What is the SMILES notation for Piperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone?
The canonical SMILES for Piperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone is O=C(c1ccc(N2CCOC(C(F)(F)F)C2)nc1)N1CCCCC1.
What is the InChIKey of Piperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone?
The InChIKey is OSGSMUCDMAFWPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20F3N3O2/c17-16(18,19)13-11-22(8-9-24-13)14-5-4-12(10-20-14)15(23)21-6-2-1-3-7-21/h4-5,10,13H,1-3,6-9,11H2.
What are the key properties of Piperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone?
Piperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone has a molecular weight of 343.35 g/mol, XLogP of 2.48, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for Piperidin-1-yl-[6-[2-(trifluoromethyl)morpholin-4-yl]-3-pyridinyl]methanone is sourced from PubChem (CID 70776837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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