N-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide

C20H15N3O2 — CID 122639225

IUPACN-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide
SMILESO=C(Nc1ccc(-c2cccnc2)c2c1C(=O)NC2)c1ccccc1
InChIInChI=1S/C20H15N3O2/c24-19(13-5-2-1-3-6-13)23-17-9-8-15(14-7-4-10-21-11-14)16-12-22-20(25)18(16)17/h1-11H,12H2,(H,22,25)(H,23,24)
InChIKeyJHNTWAGJJUKAFL-UHFFFAOYSA-N
MW329.36 g/mol
LogP3.24
Rot. Bonds3

About N-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide

N-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide (PubChem CID 122639225) has the molecular formula C20H15N3O2 and a molecular weight of 329.36 g/mol. Its IUPAC name is N-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide.

Molecular Properties

Compound NameN-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide
PubChem CID122639225
Molecular FormulaC20H15N3O2
Molecular Weight329.36 g/mol
Exact Mass329.12
IUPAC NameN-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide
SMILESO=C(Nc1ccc(-c2cccnc2)c2c1C(=O)NC2)c1ccccc1
InChIInChI=1S/C20H15N3O2/c24-19(13-5-2-1-3-6-13)23-17-9-8-15(14-7-4-10-21-11-14)16-12-22-20(25)18(16)17/h1-11H,12H2,(H,22,25)(H,23,24)
InChIKeyJHNTWAGJJUKAFL-UHFFFAOYSA-N
XLogP3.24
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide 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

N-[3-oxo-7-[4-(trifluoromethyl)phenyl]-1,2-dihydroisoindol-4-yl]benzamide
CID 122639255
(3-oxo-7-phenyl-1,2-dihydroisoindol-4-yl)carbamic acid
CID 122639210
N-[7-(3,4-difluorophenyl)-3-oxo-1,2-dihydroisoindol-4-yl]benzamide
CID 122639240
N-[7-(3-cyanophenyl)-3-oxo-1,2-dihydroisoindol-4-yl]benzamide
CID 122639188
phenyl N-(3-oxo-7-phenyl-1,2-dihydroisoindol-4-yl)carbamate
CID 140749368
3,4-dimethoxy-N-(3-oxo-7-phenyl-1,2-dihydroisoindol-4-yl)benzamide
CID 122639366
4-fluoro-N-(3-oxo-7-quinolin-6-yl-1,2-dihydroisoindol-4-yl)benzamide
CID 122639250
N-(3-oxo-7-phenyl-1,2-dihydroisoindol-4-yl)-4-(2-pyrrolidin-1-ylethylamino)benzamide
CID 122639077
4-fluoro-N-(1-oxo-5-phenyl-3,4-dihydro-2H-isoquinolin-8-yl)benzamide
CID 122639159
N-[7-(2-methylanilino)-3-oxo-1,2-dihydroisoindol-4-yl]benzamide
CID 122639387
N-[7-(3-methylanilino)-3-oxo-1,2-dihydroisoindol-4-yl]benzamide
CID 122639190
N-(1,3-dioxo-7-phenylinden-4-yl)benzamide
CID 161402375

Frequently Asked Questions

What is the IUPAC name of N-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide?
The IUPAC name of N-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide (CID 122639225) is N-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide.
What is the SMILES notation for N-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide?
The canonical SMILES for N-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide is O=C(Nc1ccc(-c2cccnc2)c2c1C(=O)NC2)c1ccccc1.
What is the InChIKey of N-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide?
The InChIKey is JHNTWAGJJUKAFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O2/c24-19(13-5-2-1-3-6-13)23-17-9-8-15(14-7-4-10-21-11-14)16-12-22-20(25)18(16)17/h1-11H,12H2,(H,22,25)(H,23,24).
What are the key properties of N-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide?
N-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide has a molecular weight of 329.36 g/mol, XLogP of 3.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-oxo-7-pyridin-3-yl-1,2-dihydroisoindol-4-yl)benzamide is sourced from PubChem (CID 122639225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).