2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide

C22H15ClN2O3 — CID 1300069

IUPAC2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1ccc2c(c1)C(=O)N(c1ccccc1)C2=O
InChIInChI=1S/C22H15ClN2O3/c23-15-8-6-14(7-9-15)12-20(26)24-16-10-11-18-19(13-16)22(28)25(21(18)27)17-4-2-1-3-5-17/h1-11,13H,12H2,(H,24,26)
InChIKeyGPGCDWSAMKNDHY-UHFFFAOYSA-N
MW390.83 g/mol
LogP4.32
Rot. Bonds4

About 2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide

2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide (PubChem CID 1300069) has the molecular formula C22H15ClN2O3 and a molecular weight of 390.83 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide
PubChem CID1300069
Molecular FormulaC22H15ClN2O3
Molecular Weight390.83 g/mol
Exact Mass390.08
IUPAC Name2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1ccc2c(c1)C(=O)N(c1ccccc1)C2=O
InChIInChI=1S/C22H15ClN2O3/c23-15-8-6-14(7-9-15)12-20(26)24-16-10-11-18-19(13-16)22(28)25(21(18)27)17-4-2-1-3-5-17/h1-11,13H,12H2,(H,24,26)
InChIKeyGPGCDWSAMKNDHY-UHFFFAOYSA-N
XLogP4.32
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.83
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(1,3-dioxo-2-phenylisoindol-5-yl)-2-methylpropanamide
CID 839386
2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide
CID 110343512
N-(3,4-dichlorophenyl)-1,3-dioxo-2-phenylisoindole-5-carboxamide
CID 1350530
2-(4-fluorophenyl)-N-(2-methyl-1,3-dioxoisoindol-5-yl)acetamide
CID 7597200
2-(2,5-dimethylphenoxy)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide
CID 3677999
N-[4-(4-chloroanilino)phenyl]-2-phenylacetamide
CID 112987026
N-[3-[(4-chlorophenyl)carbamoylamino]phenyl]-2-phenylacetamide
CID 17235520
N-(3-chloro-4-fluorophenyl)-2-phenylacetamide
CID 871803
N-(2,4-difluorophenyl)-2-[4-(1,3-dioxoisoindol-2-yl)phenyl]acetamide
CID 110343513
N-(1,3-dioxo-2-phenylisoindol-5-yl)-3-hydroxynaphthalene-2-carboxamide
CID 15176885
N-[3-(5,7-dioxopyrrolo[3,4-b]pyridin-6-yl)phenyl]-2-phenylacetamide
CID 113082993
N-[4-(2-anilino-2-oxoethyl)sulfanylphenyl]-2-(4-chlorophenyl)acetamide
CID 22775721

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide (CID 1300069) is 2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide is O=C(Cc1ccc(Cl)cc1)Nc1ccc2c(c1)C(=O)N(c1ccccc1)C2=O.
What is the InChIKey of 2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide?
The InChIKey is GPGCDWSAMKNDHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15ClN2O3/c23-15-8-6-14(7-9-15)12-20(26)24-16-10-11-18-19(13-16)22(28)25(21(18)27)17-4-2-1-3-5-17/h1-11,13H,12H2,(H,24,26).
What are the key properties of 2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide?
2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide has a molecular weight of 390.83 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide is sourced from PubChem (CID 1300069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).