2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione

C19H17NO2 — CID 142191199

IUPAC2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione
SMILESO=C1c2ccccc2C(=O)N1[C@@H]1CCCC1c1ccccc1
InChIInChI=1S/C19H17NO2/c21-18-15-9-4-5-10-16(15)19(22)20(18)17-12-6-11-14(17)13-7-2-1-3-8-13/h1-5,7-10,14,17H,6,11-12H2/t14?,17-/m1/s1
InChIKeyOCPXVXYXAKSEDE-FBMWCMRBSA-N
MW291.35 g/mol
LogP3.62
Rot. Bonds2

About 2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione

2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione (PubChem CID 142191199) has the molecular formula C19H17NO2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione.

Molecular Properties

Compound Name2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione
PubChem CID142191199
Molecular FormulaC19H17NO2
Molecular Weight291.35 g/mol
Exact Mass291.13
IUPAC Name2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione
SMILESO=C1c2ccccc2C(=O)N1[C@@H]1CCCC1c1ccccc1
InChIInChI=1S/C19H17NO2/c21-18-15-9-4-5-10-16(15)19(22)20(18)17-12-6-11-14(17)13-7-2-1-3-8-13/h1-5,7-10,14,17H,6,11-12H2/t14?,17-/m1/s1
InChIKeyOCPXVXYXAKSEDE-FBMWCMRBSA-N
XLogP3.62
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-[(1R)-2-phenylcyclopentyl]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

2-[2-(1,3-dioxoisoindol-2-yl)cyclohexyl]isoindole-1,3-dione
CID 2911337
2-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]isoindole-1,3-dione
CID 11906128
2-[(1R,2R,6S)-2-bicyclo[4.1.0]heptanyl]isoindole-1,3-dione
CID 102049318
2-[(1R,2R,4S)-2-bicyclo[2.2.1]heptanyl]isoindole-1,3-dione
CID 1296952
2-cyclodecylisoindole-1,3-dione
CID 123786237
2-[(1S,2R)-2-(4-fluorophenyl)cyclopropyl]isoindole-1,3-dione
CID 155143259
2-[(2S,3S)-1-benzhydryl-2-phenylpiperidin-3-yl]isoindole-1,3-dione
CID 132529028
2-[(1S,2R)-2-phenylmethoxycyclopentyl]isoindole-1,3-dione
CID 68810098
2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)isoindole-1,3-dione
CID 175743610
2-[(3S,5S)-2-oxo-5-phenylpyrrolidin-3-yl]isoindole-1,3-dione
CID 142755205
2-[(1R)-cyclohept-2-en-1-yl]isoindole-1,3-dione
CID 70982058
2-[(1S,3S,4R,6R,8S)-4-tricyclo[4.3.1.03,8]decanyl]isoindole-1,3-dione
CID 57333815

Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione?
The IUPAC name of 2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione (CID 142191199) is 2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione.
What is the SMILES notation for 2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione?
The canonical SMILES for 2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione is O=C1c2ccccc2C(=O)N1[C@@H]1CCCC1c1ccccc1.
What is the InChIKey of 2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione?
The InChIKey is OCPXVXYXAKSEDE-FBMWCMRBSA-N. The full InChI is InChI=1S/C19H17NO2/c21-18-15-9-4-5-10-16(15)19(22)20(18)17-12-6-11-14(17)13-7-2-1-3-8-13/h1-5,7-10,14,17H,6,11-12H2/t14?,17-/m1/s1.
What are the key properties of 2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione?
2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione has a molecular weight of 291.35 g/mol, XLogP of 3.62, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-2-phenylcyclopentyl]isoindole-1,3-dione is sourced from PubChem (CID 142191199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).