1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione

C15H10Cl2N2O2 — CID 45486192

IUPAC1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione
SMILESO=C1CCC(=O)N1c1ccc(-c2cccc(Cl)c2Cl)cn1
InChIInChI=1S/C15H10Cl2N2O2/c16-11-3-1-2-10(15(11)17)9-4-5-12(18-8-9)19-13(20)6-7-14(19)21/h1-5,8H,6-7H2
InChIKeyLVNHIYXJYVDVRB-UHFFFAOYSA-N
MW321.16 g/mol
LogP3.71
Rot. Bonds2

About 1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione

1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione (PubChem CID 45486192) has the molecular formula C15H10Cl2N2O2 and a molecular weight of 321.16 g/mol. Its IUPAC name is 1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione
PubChem CID45486192
Molecular FormulaC15H10Cl2N2O2
Molecular Weight321.16 g/mol
Exact Mass320.01
IUPAC Name1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione
SMILESO=C1CCC(=O)N1c1ccc(-c2cccc(Cl)c2Cl)cn1
InChIInChI=1S/C15H10Cl2N2O2/c16-11-3-1-2-10(15(11)17)9-4-5-12(18-8-9)19-13(20)6-7-14(19)21/h1-5,8H,6-7H2
InChIKeyLVNHIYXJYVDVRB-UHFFFAOYSA-N
XLogP3.71
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.16
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione?
The IUPAC name of 1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione (CID 45486192) is 1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione.
What is the SMILES notation for 1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione?
The canonical SMILES for 1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione is O=C1CCC(=O)N1c1ccc(-c2cccc(Cl)c2Cl)cn1.
What is the InChIKey of 1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione?
The InChIKey is LVNHIYXJYVDVRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2N2O2/c16-11-3-1-2-10(15(11)17)9-4-5-12(18-8-9)19-13(20)6-7-14(19)21/h1-5,8H,6-7H2.
What are the key properties of 1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione?
1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione has a molecular weight of 321.16 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2,3-dichlorophenyl)-2-pyridinyl]pyrrolidine-2,5-dione is sourced from PubChem (CID 45486192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).