5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one

C20H23Cl2N3O — CID 19076397

IUPAC5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one
SMILESCCN(CC)CCNC1(c2ccccc2Cl)C(=O)Nc2ccc(Cl)cc21
InChIInChI=1S/C20H23Cl2N3O/c1-3-25(4-2)12-11-23-20(15-7-5-6-8-17(15)22)16-13-14(21)9-10-18(16)24-19(20)26/h5-10,13,23H,3-4,11-12H2,1-2H3,(H,24,26)
InChIKeyJIUVJIBEGVZYEC-UHFFFAOYSA-N
MW392.33 g/mol
LogP4.12
Rot. Bonds7

About 5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one

5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one (PubChem CID 19076397) has the molecular formula C20H23Cl2N3O and a molecular weight of 392.33 g/mol. Its IUPAC name is 5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one.

Molecular Properties

Compound Name5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one
PubChem CID19076397
Molecular FormulaC20H23Cl2N3O
Molecular Weight392.33 g/mol
Exact Mass391.12
IUPAC Name5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one
SMILESCCN(CC)CCNC1(c2ccccc2Cl)C(=O)Nc2ccc(Cl)cc21
InChIInChI=1S/C20H23Cl2N3O/c1-3-25(4-2)12-11-23-20(15-7-5-6-8-17(15)22)16-13-14(21)9-10-18(16)24-19(20)26/h5-10,13,23H,3-4,11-12H2,1-2H3,(H,24,26)
InChIKeyJIUVJIBEGVZYEC-UHFFFAOYSA-N
XLogP4.12
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.33
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one?
The IUPAC name of 5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one (CID 19076397) is 5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one.
What is the SMILES notation for 5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one?
The canonical SMILES for 5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one is CCN(CC)CCNC1(c2ccccc2Cl)C(=O)Nc2ccc(Cl)cc21.
What is the InChIKey of 5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one?
The InChIKey is JIUVJIBEGVZYEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23Cl2N3O/c1-3-25(4-2)12-11-23-20(15-7-5-6-8-17(15)22)16-13-14(21)9-10-18(16)24-19(20)26/h5-10,13,23H,3-4,11-12H2,1-2H3,(H,24,26).
What are the key properties of 5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one?
5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one has a molecular weight of 392.33 g/mol, XLogP of 4.12, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-(2-chlorophenyl)-3-[2-(diethylamino)ethylamino]-1H-indol-2-one is sourced from PubChem (CID 19076397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).