4-(2,3-dichlorophenyl)morpholine-2,6-dione

C10H7Cl2NO3 — CID 63777220

IUPAC4-(2,3-dichlorophenyl)morpholine-2,6-dione
SMILESO=C1CN(c2cccc(Cl)c2Cl)CC(=O)O1
InChIInChI=1S/C10H7Cl2NO3/c11-6-2-1-3-7(10(6)12)13-4-8(14)16-9(15)5-13/h1-3H,4-5H2
InChIKeyXUXODKBNFBLCBX-UHFFFAOYSA-N
MW260.08 g/mol
LogP1.88
Rot. Bonds1

About 4-(2,3-dichlorophenyl)morpholine-2,6-dione

4-(2,3-dichlorophenyl)morpholine-2,6-dione (PubChem CID 63777220) has the molecular formula C10H7Cl2NO3 and a molecular weight of 260.08 g/mol. Its IUPAC name is 4-(2,3-dichlorophenyl)morpholine-2,6-dione.

Molecular Properties

Compound Name4-(2,3-dichlorophenyl)morpholine-2,6-dione
PubChem CID63777220
Molecular FormulaC10H7Cl2NO3
Molecular Weight260.08 g/mol
Exact Mass258.98
IUPAC Name4-(2,3-dichlorophenyl)morpholine-2,6-dione
SMILESO=C1CN(c2cccc(Cl)c2Cl)CC(=O)O1
InChIInChI=1S/C10H7Cl2NO3/c11-6-2-1-3-7(10(6)12)13-4-8(14)16-9(15)5-13/h1-3H,4-5H2
InChIKeyXUXODKBNFBLCBX-UHFFFAOYSA-N
XLogP1.88
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.08
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

4-(3-chloro-2-fluorophenyl)morpholine-2,6-dione
CID 63779224
4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one
CID 156762824
3-(2,3-dichlorophenyl)-7-methyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane
CID 44599188
2-(2,3-dichlorophenyl)-3H-isoindol-1-one
CID 842632
methyl 4-(2,3-dichlorophenyl)piperazine-1-carboxylate
CID 113080518
[4-(2,3-dichlorophenyl)piperazin-1-yl]-(furan-2-yl)methanone
CID 113080480
3-(2,3-dichlorophenyl)-2-methyl-6-(4-oxopiperidin-1-yl)pyrimidin-4-one
CID 155165313
(3R)-1-(2,3-dichlorophenyl)-3-methylpiperazine
CID 94544786
1-(2,3-dichlorophenyl)-3-methylpiperazine
CID 62670055
1-(2,3-dichlorophenyl)-1,3-diazinane-2,4-dione
CID 79776901
2-chloro-6-(3,5-dioxopiperazin-1-yl)benzaldehyde
CID 66083550
1-(2,3-dichlorophenyl)-4-(4-methylsulfonylphenyl)piperazine
CID 171690872

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dichlorophenyl)morpholine-2,6-dione?
The IUPAC name of 4-(2,3-dichlorophenyl)morpholine-2,6-dione (CID 63777220) is 4-(2,3-dichlorophenyl)morpholine-2,6-dione.
What is the SMILES notation for 4-(2,3-dichlorophenyl)morpholine-2,6-dione?
The canonical SMILES for 4-(2,3-dichlorophenyl)morpholine-2,6-dione is O=C1CN(c2cccc(Cl)c2Cl)CC(=O)O1.
What is the InChIKey of 4-(2,3-dichlorophenyl)morpholine-2,6-dione?
The InChIKey is XUXODKBNFBLCBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7Cl2NO3/c11-6-2-1-3-7(10(6)12)13-4-8(14)16-9(15)5-13/h1-3H,4-5H2.
What are the key properties of 4-(2,3-dichlorophenyl)morpholine-2,6-dione?
4-(2,3-dichlorophenyl)morpholine-2,6-dione has a molecular weight of 260.08 g/mol, XLogP of 1.88, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dichlorophenyl)morpholine-2,6-dione is sourced from PubChem (CID 63777220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).