2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine

C19H22F3N3O — CID 123186475

IUPAC2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine
SMILESCC(CCc1ccc(C(F)(F)F)cn1)c1ccc(C2CNCCO2)nc1
InChIInChI=1S/C19H22F3N3O/c1-13(2-5-16-6-4-15(11-24-16)19(20,21)22)14-3-7-17(25-10-14)18-12-23-8-9-26-18/h3-4,6-7,10-11,13,18,23H,2,5,8-9,12H2,1H3
InChIKeySOGFJMLQICNNKL-UHFFFAOYSA-N
MW365.40 g/mol
LogP3.89
Rot. Bonds5

About 2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine

2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine (PubChem CID 123186475) has the molecular formula C19H22F3N3O and a molecular weight of 365.40 g/mol. Its IUPAC name is 2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine.

Molecular Properties

Compound Name2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine
PubChem CID123186475
Molecular FormulaC19H22F3N3O
Molecular Weight365.40 g/mol
Exact Mass365.17
IUPAC Name2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine
SMILESCC(CCc1ccc(C(F)(F)F)cn1)c1ccc(C2CNCCO2)nc1
InChIInChI=1S/C19H22F3N3O/c1-13(2-5-16-6-4-15(11-24-16)19(20,21)22)14-3-7-17(25-10-14)18-12-23-8-9-26-18/h3-4,6-7,10-11,13,18,23H,2,5,8-9,12H2,1H3
InChIKeySOGFJMLQICNNKL-UHFFFAOYSA-N
XLogP3.89
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.40
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-[5-[(5-bromo-2-pyridinyl)methyl]-2-pyridinyl]morpholine
CID 153159323
(2S)-2-[5-[(5-bromo-2-pyridinyl)methyl]-2-pyridinyl]morpholine
CID 161462801
2-[[5-(trifluoromethyl)-2-pyridinyl]sulfanylmethyl]morpholine
CID 64534066
2-[4-(trifluoromethyl)phenyl]morpholine
CID 3756313
2-(4-methyloxan-2-yl)-5-(trifluoromethyl)pyridine
CID 129085545
2-morpholin-2-yl-N-[4-(trifluoromethyl)phenyl]pyrimidin-5-amine
CID 118484407
2-(6-tert-butylpyridazin-3-yl)morpholine
CID 140941619
2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride
CID 171371651
2-(azetidin-3-yl)-5-(trifluoromethyl)pyridine
CID 71302276
N-[3-[3-(trifluoromethyl)phenyl]butyl]morpholine-2-carboxamide
CID 119814995
5-fluoro-6-[(2S)-morpholin-2-yl]-N-[5-(trifluoromethyl)-2-pyridinyl]pyridin-3-amine
CID 125487816
2-pyridin-2-ylmorpholine
CID 19353403

Frequently Asked Questions

What is the IUPAC name of 2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine?
The IUPAC name of 2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine (CID 123186475) is 2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine.
What is the SMILES notation for 2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine?
The canonical SMILES for 2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine is CC(CCc1ccc(C(F)(F)F)cn1)c1ccc(C2CNCCO2)nc1.
What is the InChIKey of 2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine?
The InChIKey is SOGFJMLQICNNKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22F3N3O/c1-13(2-5-16-6-4-15(11-24-16)19(20,21)22)14-3-7-17(25-10-14)18-12-23-8-9-26-18/h3-4,6-7,10-11,13,18,23H,2,5,8-9,12H2,1H3.
What are the key properties of 2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine?
2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine has a molecular weight of 365.40 g/mol, XLogP of 3.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[4-[5-(trifluoromethyl)-2-pyridinyl]butan-2-yl]-2-pyridinyl]morpholine is sourced from PubChem (CID 123186475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).