3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione

C14H16FNO3 — CID 79430356

IUPAC3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione
SMILESCOCC1(C)CC(=O)NC(=O)C1c1cccc(F)c1
InChIInChI=1S/C14H16FNO3/c1-14(8-19-2)7-11(17)16-13(18)12(14)9-4-3-5-10(15)6-9/h3-6,12H,7-8H2,1-2H3,(H,16,17,18)
InChIKeyREMZCNZCCUXYAP-UHFFFAOYSA-N
MW265.28 g/mol
LogP1.61
Rot. Bonds3

About 3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione

3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione (PubChem CID 79430356) has the molecular formula C14H16FNO3 and a molecular weight of 265.28 g/mol. Its IUPAC name is 3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione.

Molecular Properties

Compound Name3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione
PubChem CID79430356
Molecular FormulaC14H16FNO3
Molecular Weight265.28 g/mol
Exact Mass265.11
IUPAC Name3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione
SMILESCOCC1(C)CC(=O)NC(=O)C1c1cccc(F)c1
InChIInChI=1S/C14H16FNO3/c1-14(8-19-2)7-11(17)16-13(18)12(14)9-4-3-5-10(15)6-9/h3-6,12H,7-8H2,1-2H3,(H,16,17,18)
InChIKeyREMZCNZCCUXYAP-UHFFFAOYSA-N
XLogP1.61
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.28
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione?
The IUPAC name of 3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione (CID 79430356) is 3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione.
What is the SMILES notation for 3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione?
The canonical SMILES for 3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione is COCC1(C)CC(=O)NC(=O)C1c1cccc(F)c1.
What is the InChIKey of 3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione?
The InChIKey is REMZCNZCCUXYAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FNO3/c1-14(8-19-2)7-11(17)16-13(18)12(14)9-4-3-5-10(15)6-9/h3-6,12H,7-8H2,1-2H3,(H,16,17,18).
What are the key properties of 3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione?
3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione has a molecular weight of 265.28 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluorophenyl)-4-(methoxymethyl)-4-methylpiperidine-2,6-dione is sourced from PubChem (CID 79430356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).