1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione

C16H14N2O2 — CID 123155875

IUPAC1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione
SMILESO=C1CCN(c2cc(-c3ccccc3)ccn2)CC1=O
InChIInChI=1S/C16H14N2O2/c19-14-7-9-18(11-15(14)20)16-10-13(6-8-17-16)12-4-2-1-3-5-12/h1-6,8,10H,7,9,11H2
InChIKeyPIYTUYZQHPEDND-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.10
Rot. Bonds2

About 1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione

1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione (PubChem CID 123155875) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione.

Molecular Properties

Compound Name1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione
PubChem CID123155875
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione
SMILESO=C1CCN(c2cc(-c3ccccc3)ccn2)CC1=O
InChIInChI=1S/C16H14N2O2/c19-14-7-9-18(11-15(14)20)16-10-13(6-8-17-16)12-4-2-1-3-5-12/h1-6,8,10H,7,9,11H2
InChIKeyPIYTUYZQHPEDND-UHFFFAOYSA-N
XLogP2.10
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

2-chloro-5-ethyl-1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione
CID 123377733
3-hydroxy-1-(4-phenyl-2-pyridinyl)pyridin-4-one
CID 67419505
4-[4-(5-phenyl-3H-isoindol-1-yl)-2-pyridinyl]morpholine
CID 157153991
osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine)
CID 159449942
CID 58036408
CID 58036408
4-(4-phenylphenyl)-2-(3-pyridin-2-yloxypyrrol-1-yl)pyridine
CID 140818882
4-[4-(6-phenyl-1H-indazol-3-yl)-2-pyridinyl]morpholine
CID 90400805
(2-amino-2-oxoethyl) N-[2-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]ethyl]carbamate
CID 68573837
2,4-diphenyl-6-(2-piperazin-1-yl-4-pyridinyl)pyrimidine
CID 171686343
2-bromo-4-(4-phenylphenyl)pyridine
CID 138597174
heptalene-2,3-dione
CID 71333397
1-[4-(4-chlorophenyl)-2-pyridinyl]piperazine
CID 171059987

Frequently Asked Questions

What is the IUPAC name of 1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione?
The IUPAC name of 1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione (CID 123155875) is 1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione.
What is the SMILES notation for 1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione?
The canonical SMILES for 1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione is O=C1CCN(c2cc(-c3ccccc3)ccn2)CC1=O.
What is the InChIKey of 1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione?
The InChIKey is PIYTUYZQHPEDND-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c19-14-7-9-18(11-15(14)20)16-10-13(6-8-17-16)12-4-2-1-3-5-12/h1-6,8,10H,7,9,11H2.
What are the key properties of 1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione?
1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione has a molecular weight of 266.30 g/mol, XLogP of 2.10, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-phenyl-2-pyridinyl)piperidine-3,4-dione is sourced from PubChem (CID 123155875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).