4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione

C11H17NO4 — CID 104753189

IUPAC4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione
SMILESO=C1COCC(=O)N1CC(O)C1CCCC1
InChIInChI=1S/C11H17NO4/c13-9(8-3-1-2-4-8)5-12-10(14)6-16-7-11(12)15/h8-9,13H,1-7H2
InChIKeyZFINGDYMVZEOGW-UHFFFAOYSA-N
MW227.26 g/mol
LogP-0.08
Rot. Bonds3

About 4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione

4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione (PubChem CID 104753189) has the molecular formula C11H17NO4 and a molecular weight of 227.26 g/mol. Its IUPAC name is 4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione.

Molecular Properties

Compound Name4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione
PubChem CID104753189
Molecular FormulaC11H17NO4
Molecular Weight227.26 g/mol
Exact Mass227.12
IUPAC Name4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione
SMILESO=C1COCC(=O)N1CC(O)C1CCCC1
InChIInChI=1S/C11H17NO4/c13-9(8-3-1-2-4-8)5-12-10(14)6-16-7-11(12)15/h8-9,13H,1-7H2
InChIKeyZFINGDYMVZEOGW-UHFFFAOYSA-N
XLogP-0.08
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 5-0.08
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

4-(2-cyclopentyl-2-hydroxyethyl)-1,4-benzoxazin-3-one
CID 104753134
4-(2,3-dihydroxypropyl)morpholine-3,5-dione
CID 66176288
3-(2-cyclopentyl-2-hydroxyethyl)-3-azabicyclo[3.1.0]hexane-2,4-dione
CID 104753293
4-(2-cyclopropyl-2-hydroxyethyl)thiomorpholine-3,5-dione
CID 104570913
1-(2-cyclopentyl-2-hydroxyethyl)-4-ethylpyrrolidin-2-one
CID 104753333
4-(2,2-dimethoxyethyl)morpholine-3,5-dione
CID 60976068
1-(2-cyclopropyl-2-hydroxyethyl)pyrrole-2,5-dione
CID 63296638
1-(2-cyclopentyl-2-hydroxyethyl)azepan-2-one
CID 104753129
4-(2-cyclopentyl-2-oxoethyl)morpholine-3,5-dione
CID 104751314
1-(2-cyclopropyl-2-hydroxyethyl)-3,4-dimethylpyrrole-2,5-dione
CID 63296457
4-(2-hydroxy-2-phenylethyl)morpholine-3,5-dione
CID 61328165
1-(2-cyclopentyl-2-hydroxyethyl)-4-methylpiperazine-2,3-dione
CID 113449235

Frequently Asked Questions

What is the IUPAC name of 4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione?
The IUPAC name of 4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione (CID 104753189) is 4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione.
What is the SMILES notation for 4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione?
The canonical SMILES for 4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione is O=C1COCC(=O)N1CC(O)C1CCCC1.
What is the InChIKey of 4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione?
The InChIKey is ZFINGDYMVZEOGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO4/c13-9(8-3-1-2-4-8)5-12-10(14)6-16-7-11(12)15/h8-9,13H,1-7H2.
What are the key properties of 4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione?
4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione has a molecular weight of 227.26 g/mol, XLogP of -0.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclopentyl-2-hydroxyethyl)morpholine-3,5-dione is sourced from PubChem (CID 104753189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).