3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione

C11H10F3N3O2 — CID 66328290

IUPAC3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione
SMILESO=C1CCC(Nc2cc(C(F)(F)F)ccn2)C(=O)N1
InChIInChI=1S/C11H10F3N3O2/c12-11(13,14)6-3-4-15-8(5-6)16-7-1-2-9(18)17-10(7)19/h3-5,7H,1-2H2,(H,15,16)(H,17,18,19)
InChIKeyKNLUTSKSFHPFOP-UHFFFAOYSA-N
MW273.21 g/mol
LogP1.32
Rot. Bonds2

About 3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione

3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione (PubChem CID 66328290) has the molecular formula C11H10F3N3O2 and a molecular weight of 273.21 g/mol. Its IUPAC name is 3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione.

Molecular Properties

Compound Name3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione
PubChem CID66328290
Molecular FormulaC11H10F3N3O2
Molecular Weight273.21 g/mol
Exact Mass273.07
IUPAC Name3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione
SMILESO=C1CCC(Nc2cc(C(F)(F)F)ccn2)C(=O)N1
InChIInChI=1S/C11H10F3N3O2/c12-11(13,14)6-3-4-15-8(5-6)16-7-1-2-9(18)17-10(7)19/h3-5,7H,1-2H2,(H,15,16)(H,17,18,19)
InChIKeyKNLUTSKSFHPFOP-UHFFFAOYSA-N
XLogP1.32
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.21
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[[2-(methylamino)-6-(trifluoromethyl)pyrimidin-4-yl]amino]piperidine-2,6-dione
CID 114565360
N-[(3R)-pyrrolidin-3-yl]-4-(trifluoromethyl)pyridin-2-amine
CID 122441469
N-[4-(trifluoromethyl)-2-pyridinyl]azepan-4-amine
CID 107173809
3-[5-bromo-2-(trifluoromethyl)anilino]piperidine-2,6-dione
CID 107286372
N-[(1R)-1-[[4-(trifluoromethyl)-2-pyridinyl]amino]-2,3-dihydro-1H-inden-5-yl]prop-2-enamide
CID 162688006
N-cyclohex-3-en-1-yl-4-(trifluoromethyl)pyridin-2-amine
CID 66331048
N-(2-ethylcyclopropyl)-4-(trifluoromethyl)pyridin-2-amine
CID 103736545
ethane;3-[(5-propan-2-yl-2-pyridinyl)amino]piperidine-2,6-dione
CID 170749748
3-(2,5-difluoroanilino)piperidine-2,6-dione
CID 170749830
3-[(6-amino-2-ethylpyrimidin-4-yl)amino]piperidine-2,6-dione
CID 80941106
3-[(2-amino-3-pyridinyl)amino]piperidine-2,6-dione
CID 104540520
N-(1-methylpyrrolidin-3-yl)-4-(trifluoromethyl)pyridin-2-amine
CID 66329255

Frequently Asked Questions

What is the IUPAC name of 3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione?
The IUPAC name of 3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione (CID 66328290) is 3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione.
What is the SMILES notation for 3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione?
The canonical SMILES for 3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione is O=C1CCC(Nc2cc(C(F)(F)F)ccn2)C(=O)N1.
What is the InChIKey of 3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione?
The InChIKey is KNLUTSKSFHPFOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3N3O2/c12-11(13,14)6-3-4-15-8(5-6)16-7-1-2-9(18)17-10(7)19/h3-5,7H,1-2H2,(H,15,16)(H,17,18,19).
What are the key properties of 3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione?
3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione has a molecular weight of 273.21 g/mol, XLogP of 1.32, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-(trifluoromethyl)-2-pyridinyl]amino]piperidine-2,6-dione is sourced from PubChem (CID 66328290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).