4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione

C10H6Cl2FNO3 — CID 83081600

IUPAC4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione
SMILESO=C1CN(c2c(Cl)cc(F)cc2Cl)CC(=O)O1
InChIInChI=1S/C10H6Cl2FNO3/c11-6-1-5(13)2-7(12)10(6)14-3-8(15)17-9(16)4-14/h1-2H,3-4H2
InChIKeyAPQYJNOXKISIOI-UHFFFAOYSA-N
MW278.07 g/mol
LogP2.02
Rot. Bonds1

About 4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione

4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione (PubChem CID 83081600) has the molecular formula C10H6Cl2FNO3 and a molecular weight of 278.07 g/mol. Its IUPAC name is 4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione.

Molecular Properties

Compound Name4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione
PubChem CID83081600
Molecular FormulaC10H6Cl2FNO3
Molecular Weight278.07 g/mol
Exact Mass276.97
IUPAC Name4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione
SMILESO=C1CN(c2c(Cl)cc(F)cc2Cl)CC(=O)O1
InChIInChI=1S/C10H6Cl2FNO3/c11-6-1-5(13)2-7(12)10(6)14-3-8(15)17-9(16)4-14/h1-2H,3-4H2
InChIKeyAPQYJNOXKISIOI-UHFFFAOYSA-N
XLogP2.02
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.07
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 2-(2,6-dichloro-N-(2-fluoroacetyl)anilino)propanoate
CID 21427650
Ethyl 2-(4,4-difluoro-1,1-dioxido-6-(2,4,6-trichlorophenyl)-1,2,6-thiadiazinan-2-yl)acetate
CID 86708934
Ethyl 2-[4,4-difluoro-1,1-dihydroxy-6-(2,4,6-trichlorophenyl)-1,2,6-thiadiazinan-2-yl]acetate
CID 89926691
2-[4,4-Difluoro-1,1-dihydroxy-6-(2,4,6-trichlorophenyl)-1,2,6-thiadiazinan-2-yl]acetic acid
CID 89927017
3,4,4-Trifluorobut-3-enyl 2-[4-(2-chlorophenyl)piperazin-1-yl]acetate
CID 177947495
3,4,4-Trifluorobut-3-enyl 2-[4-(2,4,6-trichlorophenyl)piperazin-1-yl]acetate
CID 177947509
2-(2-chloro-6-fluoro-N-formylanilino)acetic acid
CID 20848546
4-(2-Chloro-4-fluorophenyl)morpholine-2,6-dione
CID 63776869
4-(3-Chloro-4-fluorophenyl)morpholine-2,6-dione
CID 63779222
4-(3-Chloro-2-fluorophenyl)morpholine-2,6-dione
CID 63779224
4-(5-Chloro-2-fluorophenyl)morpholine-2,6-dione
CID 63779227
4-(4-Chloro-3-fluorophenyl)morpholine-2,6-dione
CID 63787842

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione?
The IUPAC name of 4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione (CID 83081600) is 4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione.
What is the SMILES notation for 4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione?
The canonical SMILES for 4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione is O=C1CN(c2c(Cl)cc(F)cc2Cl)CC(=O)O1.
What is the InChIKey of 4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione?
The InChIKey is APQYJNOXKISIOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2FNO3/c11-6-1-5(13)2-7(12)10(6)14-3-8(15)17-9(16)4-14/h1-2H,3-4H2.
What are the key properties of 4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione?
4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione has a molecular weight of 278.07 g/mol, XLogP of 2.02, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dichloro-4-fluorophenyl)morpholine-2,6-dione is sourced from PubChem (CID 83081600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).