4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine

C15H20F3N3O — CID 171691128

IUPAC4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine
SMILESFC(F)(F)c1cc(N2CCC(N3CCOCC3)CC2)ccn1
InChIInChI=1S/C15H20F3N3O/c16-15(17,18)14-11-13(1-4-19-14)20-5-2-12(3-6-20)21-7-9-22-10-8-21/h1,4,11-12H,2-3,5-10H2
InChIKeyRUSBNFOIPANZBI-UHFFFAOYSA-N
MW315.34 g/mol
LogP2.40
Rot. Bonds2

About 4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine

4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine (PubChem CID 171691128) has the molecular formula C15H20F3N3O and a molecular weight of 315.34 g/mol. Its IUPAC name is 4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine
PubChem CID171691128
Molecular FormulaC15H20F3N3O
Molecular Weight315.34 g/mol
Exact Mass315.16
IUPAC Name4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine
SMILESFC(F)(F)c1cc(N2CCC(N3CCOCC3)CC2)ccn1
InChIInChI=1S/C15H20F3N3O/c16-15(17,18)14-11-13(1-4-19-14)20-5-2-12(3-6-20)21-7-9-22-10-8-21/h1,4,11-12H,2-3,5-10H2
InChIKeyRUSBNFOIPANZBI-UHFFFAOYSA-N
XLogP2.40
TPSA28.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.34
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

morpholin-4-yl-[1-[2-(trifluoromethyl)-4-pyridinyl]pyrrolidin-3-yl]methanone
CID 165434721
1-phenyl-4-[2-(trifluoromethyl)-4-pyridinyl]piperazine
CID 175649905
N-chloro-1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-amine
CID 118054993
4-[2-[4-[2-(trifluoromethyl)-4-pyridinyl]piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 155800202
4-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-2-carbonitrile
CID 63511845
[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]carbamic acid
CID 67341843
1-[2-(trifluoromethyl)-4-pyridinyl]piperazine;dihydrochloride
CID 154825576
(2S,6R)-2,6-dimethyl-4-[2-(trifluoromethyl)-4-pyridinyl]morpholine
CID 155974206
5-(4-morpholin-4-ylpiperidin-1-yl)pyridin-2-amine
CID 67513413
2-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-4-amine
CID 117078995
3-methyl-8-[2-(trifluoromethyl)-4-pyridinyl]-8-azaspiro[4.5]decane
CID 91080290
2-[4-[2-(trifluoromethyl)-4-pyridinyl]piperazin-1-yl]ethanol
CID 171701811

Frequently Asked Questions

What is the IUPAC name of 4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine?
The IUPAC name of 4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine (CID 171691128) is 4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine.
What is the SMILES notation for 4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine?
The canonical SMILES for 4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine is FC(F)(F)c1cc(N2CCC(N3CCOCC3)CC2)ccn1.
What is the InChIKey of 4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine?
The InChIKey is RUSBNFOIPANZBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F3N3O/c16-15(17,18)14-11-13(1-4-19-14)20-5-2-12(3-6-20)21-7-9-22-10-8-21/h1,4,11-12H,2-3,5-10H2.
What are the key properties of 4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine?
4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine has a molecular weight of 315.34 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-yl]morpholine is sourced from PubChem (CID 171691128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).