2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione

C19H15ClN2O4 — CID 2100384

IUPAC2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione
SMILESO=C(c1ccc2c(c1)C(=O)N(c1ccc(Cl)cc1)C2=O)N1CCOCC1
InChIInChI=1S/C19H15ClN2O4/c20-13-2-4-14(5-3-13)22-18(24)15-6-1-12(11-16(15)19(22)25)17(23)21-7-9-26-10-8-21/h1-6,11H,7-10H2
InChIKeyZNWFJWRFRNGRNA-UHFFFAOYSA-N
MW370.79 g/mol
LogP2.61
Rot. Bonds2

About 2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione

2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione (PubChem CID 2100384) has the molecular formula C19H15ClN2O4 and a molecular weight of 370.79 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione.

Molecular Properties

Compound Name2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione
PubChem CID2100384
Molecular FormulaC19H15ClN2O4
Molecular Weight370.79 g/mol
Exact Mass370.07
IUPAC Name2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione
SMILESO=C(c1ccc2c(c1)C(=O)N(c1ccc(Cl)cc1)C2=O)N1CCOCC1
InChIInChI=1S/C19H15ClN2O4/c20-13-2-4-14(5-3-13)22-18(24)15-6-1-12(11-16(15)19(22)25)17(23)21-7-9-26-10-8-21/h1-6,11H,7-10H2
InChIKeyZNWFJWRFRNGRNA-UHFFFAOYSA-N
XLogP2.61
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.79
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-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

(1-morpholin-4-yl-1-oxopropan-2-yl) 2-(4-chlorophenyl)-1,3-dioxoisoindole-5-carboxylate
CID 16506175
2-(4-chlorophenyl)-5-(3-fluoroazetidine-1-carbonyl)isoindole-1,3-dione
CID 167939575
3-chloro-1-(4-chlorophenyl)-4-[2-methyl-5-(morpholine-4-carbonyl)anilino]pyrrole-2,5-dione
CID 1407609
6-bromo-2-[4-(morpholine-4-carbonyl)phenyl]benzo[de]isoquinoline-1,3-dione
CID 1221078
[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone
CID 89134303
[2-(azepan-1-yl)-2-oxoethyl] 2-(4-chlorophenyl)-1,3-dioxoisoindole-5-carboxylate
CID 16506188
5-bromo-2-[4-(morpholine-4-carbonyl)phenyl]benzo[de]isoquinoline-1,3-dione
CID 1107269
2-(4-carbonochloridoylphenyl)-1,3-dioxoisoindole-5-carbonyl chloride
CID 3557802
(4-chloro-3-phenylphenyl)-morpholin-4-ylmethanone
CID 110675198
(3-bromo-4-fluorophenyl)-morpholin-4-ylmethanone
CID 46738891
(4-chlorophenyl)-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone
CID 113073693
[4-chloro-3-(6-hydroxynaphthalen-2-yl)phenyl]-morpholin-4-ylmethanone
CID 67203926

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione?
The IUPAC name of 2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione (CID 2100384) is 2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione.
What is the SMILES notation for 2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione?
The canonical SMILES for 2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione is O=C(c1ccc2c(c1)C(=O)N(c1ccc(Cl)cc1)C2=O)N1CCOCC1.
What is the InChIKey of 2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione?
The InChIKey is ZNWFJWRFRNGRNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN2O4/c20-13-2-4-14(5-3-13)22-18(24)15-6-1-12(11-16(15)19(22)25)17(23)21-7-9-26-10-8-21/h1-6,11H,7-10H2.
What are the key properties of 2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione?
2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione has a molecular weight of 370.79 g/mol, XLogP of 2.61, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-5-(morpholine-4-carbonyl)isoindole-1,3-dione is sourced from PubChem (CID 2100384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).