3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione

C15H19NO5 — CID 167027389

IUPAC3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione
SMILESCOCCCOc1ccc(OC2CCC(=O)NC2=O)cc1
InChIInChI=1S/C15H19NO5/c1-19-9-2-10-20-11-3-5-12(6-4-11)21-13-7-8-14(17)16-15(13)18/h3-6,13H,2,7-10H2,1H3,(H,16,17,18)
InChIKeyOOUNDBJJJKBGPU-UHFFFAOYSA-N
MW293.32 g/mol
LogP1.29
Rot. Bonds7

About 3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione

3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione (PubChem CID 167027389) has the molecular formula C15H19NO5 and a molecular weight of 293.32 g/mol. Its IUPAC name is 3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione.

Molecular Properties

Compound Name3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione
PubChem CID167027389
Molecular FormulaC15H19NO5
Molecular Weight293.32 g/mol
Exact Mass293.13
IUPAC Name3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione
SMILESCOCCCOc1ccc(OC2CCC(=O)NC2=O)cc1
InChIInChI=1S/C15H19NO5/c1-19-9-2-10-20-11-3-5-12(6-4-11)21-13-7-8-14(17)16-15(13)18/h3-6,13H,2,7-10H2,1H3,(H,16,17,18)
InChIKeyOOUNDBJJJKBGPU-UHFFFAOYSA-N
XLogP1.29
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-[4-(dimethylamino)phenoxy]piperidine-2,6-dione
CID 155261508
3-(4-methylphenoxy)pyrrolidine-2,5-dione
CID 20648098
3-(4-hexoxyphenyl)piperidine-2,6-dione
CID 172584857
3-[4-[[(3S)-morpholin-3-yl]methyl]phenoxy]piperidine-2,6-dione
CID 166471884
3-(3-fluorosulfonyloxy-4-methoxyphenoxy)-2,6-dioxopiperidine;molecular hydrogen
CID 177010401
4-[4-(2,6-dioxopiperidin-3-yl)oxyphenyl]piperazine-1-carboxylic acid
CID 156506164
4-[4-[4-(2,6-dioxopiperidin-3-yl)oxyphenyl]piperidin-1-yl]butanoic acid
CID 159240821
7-(4-methoxybutoxy)-3,4-dihydro-1H-quinolin-2-one
CID 114940015
3-[4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)phenoxy]piperidine-2,6-dione
CID 172616793
3-[4-[(2,6-dioxopiperidin-3-yl)amino]phenoxy]propyl hypoiodite
CID 170007516
3-[4-(3-piperazin-1-ylazetidin-1-yl)phenoxy]piperidine-2,6-dione
CID 177362134
3-[4-[1-(1-aminoethenyl)piperidin-4-yl]phenoxy]piperidine-2,6-dione
CID 162725566

Frequently Asked Questions

What is the IUPAC name of 3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione?
The IUPAC name of 3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione (CID 167027389) is 3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione.
What is the SMILES notation for 3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione?
The canonical SMILES for 3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione is COCCCOc1ccc(OC2CCC(=O)NC2=O)cc1.
What is the InChIKey of 3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione?
The InChIKey is OOUNDBJJJKBGPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO5/c1-19-9-2-10-20-11-3-5-12(6-4-11)21-13-7-8-14(17)16-15(13)18/h3-6,13H,2,7-10H2,1H3,(H,16,17,18).
What are the key properties of 3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione?
3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione has a molecular weight of 293.32 g/mol, XLogP of 1.29, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(3-methoxypropoxy)phenoxy]piperidine-2,6-dione is sourced from PubChem (CID 167027389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).