4-(2-phenylpropyl)piperidine-2,6-dione

C14H17NO2 — CID 63156337

IUPAC4-(2-phenylpropyl)piperidine-2,6-dione
SMILESCC(CC1CC(=O)NC(=O)C1)c1ccccc1
InChIInChI=1S/C14H17NO2/c1-10(12-5-3-2-4-6-12)7-11-8-13(16)15-14(17)9-11/h2-6,10-11H,7-9H2,1H3,(H,15,16,17)
InChIKeyMZPIELPGFBRYNW-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.23
Rot. Bonds3

About 4-(2-phenylpropyl)piperidine-2,6-dione

4-(2-phenylpropyl)piperidine-2,6-dione (PubChem CID 63156337) has the molecular formula C14H17NO2 and a molecular weight of 231.30 g/mol. Its IUPAC name is 4-(2-phenylpropyl)piperidine-2,6-dione.

Molecular Properties

Compound Name4-(2-phenylpropyl)piperidine-2,6-dione
PubChem CID63156337
Molecular FormulaC14H17NO2
Molecular Weight231.30 g/mol
Exact Mass231.13
IUPAC Name4-(2-phenylpropyl)piperidine-2,6-dione
SMILESCC(CC1CC(=O)NC(=O)C1)c1ccccc1
InChIInChI=1S/C14H17NO2/c1-10(12-5-3-2-4-6-12)7-11-8-13(16)15-14(17)9-11/h2-6,10-11H,7-9H2,1H3,(H,15,16,17)
InChIKeyMZPIELPGFBRYNW-UHFFFAOYSA-N
XLogP2.23
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[(2S)-1-cyclopropylpropan-2-yl]benzene
CID 169109278
(2R)-2-[(2R)-2-phenylpropyl]imidazolidin-4-one
CID 129386210
(3R)-3-[(2R)-2-phenylpropyl]pyrrolidine
CID 86324114
3-ethyl-4-(1-phenylethyl)piperidine-2,6-dione
CID 79321359
3,4-bis(2-phenylpropyl)oxolane-2,5-dione
CID 21344826
1-cyclopropyl-4-imino-5-(2-phenylpropyl)imidazolidin-2-one
CID 138388566
3-methyl-4-(1-phenylethyl)piperidine-2,6-dione
CID 79317878
1-methyl-4-[4-[(2R)-2-phenylpropyl]cyclohexyl]benzene
CID 163627062
1-[4-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]cyclohexyl]propan-2-ylbenzene
CID 21052654
1-fluoro-4-[4-[4-(2-phenylpropyl)cyclohexyl]cyclohexyl]benzene
CID 21052652
1-fluoro-4-[4-[4-(2-phenylpropyl)cyclohexyl]phenyl]benzene
CID 21052589
4-[2-[4-[4-[(2R)-2-phenylpropyl]cyclohexyl]cyclohexyl]ethyl]cyclohexan-1-ol
CID 71102889

Frequently Asked Questions

What is the IUPAC name of 4-(2-phenylpropyl)piperidine-2,6-dione?
The IUPAC name of 4-(2-phenylpropyl)piperidine-2,6-dione (CID 63156337) is 4-(2-phenylpropyl)piperidine-2,6-dione.
What is the SMILES notation for 4-(2-phenylpropyl)piperidine-2,6-dione?
The canonical SMILES for 4-(2-phenylpropyl)piperidine-2,6-dione is CC(CC1CC(=O)NC(=O)C1)c1ccccc1.
What is the InChIKey of 4-(2-phenylpropyl)piperidine-2,6-dione?
The InChIKey is MZPIELPGFBRYNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-10(12-5-3-2-4-6-12)7-11-8-13(16)15-14(17)9-11/h2-6,10-11H,7-9H2,1H3,(H,15,16,17).
What are the key properties of 4-(2-phenylpropyl)piperidine-2,6-dione?
4-(2-phenylpropyl)piperidine-2,6-dione has a molecular weight of 231.30 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenylpropyl)piperidine-2,6-dione is sourced from PubChem (CID 63156337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).