3-hydroxy-1-methoxypiperidine-2,6-dione

C6H9NO4 — CID 167136496

IUPAC3-hydroxy-1-methoxypiperidine-2,6-dione
SMILESCON1C(=O)CCC(O)C1=O
InChIInChI=1S/C6H9NO4/c1-11-7-5(9)3-2-4(8)6(7)10/h4,8H,2-3H2,1H3
InChIKeyKVOHILOJYGHTMR-UHFFFAOYSA-N
MW159.14 g/mol
LogP-0.94
Rot. Bonds1

About 3-hydroxy-1-methoxypiperidine-2,6-dione

3-hydroxy-1-methoxypiperidine-2,6-dione (PubChem CID 167136496) has the molecular formula C6H9NO4 and a molecular weight of 159.14 g/mol. Its IUPAC name is 3-hydroxy-1-methoxypiperidine-2,6-dione.

Molecular Properties

Compound Name3-hydroxy-1-methoxypiperidine-2,6-dione
PubChem CID167136496
Molecular FormulaC6H9NO4
Molecular Weight159.14 g/mol
Exact Mass159.05
IUPAC Name3-hydroxy-1-methoxypiperidine-2,6-dione
SMILESCON1C(=O)CCC(O)C1=O
InChIInChI=1S/C6H9NO4/c1-11-7-5(9)3-2-4(8)6(7)10/h4,8H,2-3H2,1H3
InChIKeyKVOHILOJYGHTMR-UHFFFAOYSA-N
XLogP-0.94
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.14
LogP ≤ 5-0.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-methanidyl-1-methoxypyrrolidine-2,5-dione
CID 90919377
3-hexyl-1-methoxypiperidine-2,6-dione
CID 59172801
1-methoxyazepane-2,7-dione
CID 134892605
3-(5-fluoro-1,3-dihydroisoindol-2-yl)-1-methoxypiperidine-2,6-dione
CID 170566104
5-hydroxy-1-(2-methoxyethyl)pyrrolidin-2-one
CID 148668115
4-methoxy-4-azatricyclo[5.2.2.02,6]undec-8-ene-3,5-dione
CID 59172851
1-amino-5-methoxypyrrolidin-2-one
CID 123886673
(5R)-5-hydroxy-1-[(4-methoxyphenyl)methyl]pyrrolidin-2-one
CID 124629774
(5R)-1-hydroxy-5-methylpyrrolidin-2-one
CID 56612622
ethane;1-methoxy-2,5-dioxopyrrolidine-3-sulfonic acid
CID 143201106
5-methoxy-1-methylazepan-2-one
CID 59421614
(5S)-5-methoxy-1-propan-2-ylpyrrolidin-2-one
CID 178109240

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-1-methoxypiperidine-2,6-dione?
The IUPAC name of 3-hydroxy-1-methoxypiperidine-2,6-dione (CID 167136496) is 3-hydroxy-1-methoxypiperidine-2,6-dione.
What is the SMILES notation for 3-hydroxy-1-methoxypiperidine-2,6-dione?
The canonical SMILES for 3-hydroxy-1-methoxypiperidine-2,6-dione is CON1C(=O)CCC(O)C1=O.
What is the InChIKey of 3-hydroxy-1-methoxypiperidine-2,6-dione?
The InChIKey is KVOHILOJYGHTMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO4/c1-11-7-5(9)3-2-4(8)6(7)10/h4,8H,2-3H2,1H3.
What are the key properties of 3-hydroxy-1-methoxypiperidine-2,6-dione?
3-hydroxy-1-methoxypiperidine-2,6-dione has a molecular weight of 159.14 g/mol, XLogP of -0.94, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-1-methoxypiperidine-2,6-dione is sourced from PubChem (CID 167136496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).