N-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide

C23H24N2O4 — CID 2233800

IUPACN-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)Nc1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O
InChIInChI=1S/C23H24N2O4/c1-2-29-20-11-7-6-10-18(20)21(26)24-15-12-13-17-19(14-15)23(28)25(22(17)27)16-8-4-3-5-9-16/h6-7,10-14,16H,2-5,8-9H2,1H3,(H,24,26)
InChIKeyVCGOKBWNWBBRJP-UHFFFAOYSA-N
MW392.46 g/mol
LogP4.27
Rot. Bonds5

About N-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide

N-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide (PubChem CID 2233800) has the molecular formula C23H24N2O4 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide.

Molecular Properties

Compound NameN-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide
PubChem CID2233800
Molecular FormulaC23H24N2O4
Molecular Weight392.46 g/mol
Exact Mass392.17
IUPAC NameN-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)Nc1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O
InChIInChI=1S/C23H24N2O4/c1-2-29-20-11-7-6-10-18(20)21(26)24-15-12-13-17-19(14-15)23(28)25(22(17)27)16-8-4-3-5-9-16/h6-7,10-14,16H,2-5,8-9H2,1H3,(H,24,26)
InChIKeyVCGOKBWNWBBRJP-UHFFFAOYSA-N
XLogP4.27
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide 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

[4-[(2-cyclohexyl-1,3-dioxoisoindol-5-yl)carbamoyl]phenyl] propanoate
CID 2221764
[2-(2-ethoxyanilino)-2-oxoethyl] 2-cyclohexyl-1,3-dioxoisoindole-5-carboxylate
CID 41179628
2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206
(2R)-N-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-phenylbutanamide
CID 2233436
2-cyclohexyl-N-[2-[(2-methoxybenzoyl)amino]ethyl]-1,3-dioxoisoindole-5-carboxamide
CID 108538044
1-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-3-(4-methylphenyl)urea
CID 108873895
N-[3-[1,3-dioxo-2-(oxolan-2-ylmethyl)isoindol-5-yl]oxyphenyl]-2-ethoxybenzamide
CID 17361930
1-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-3-[4-(diethylamino)phenyl]urea
CID 108874139
1-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-3-(3-phenylpropyl)urea
CID 108874248
2-ethoxy-N-[4-(propanoylamino)phenyl]benzamide
CID 17204882
methyl 3-[(2-cyclohexyl-1,3-dioxoisoindol-5-yl)carbamoylamino]benzoate
CID 108874216
(2-cyclohexyl-1,3-dioxoisoindol-5-yl)thiourea
CID 169358891

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide?
The IUPAC name of N-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide (CID 2233800) is N-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide.
What is the SMILES notation for N-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide?
The canonical SMILES for N-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide is CCOc1ccccc1C(=O)Nc1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O.
What is the InChIKey of N-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide?
The InChIKey is VCGOKBWNWBBRJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4/c1-2-29-20-11-7-6-10-18(20)21(26)24-15-12-13-17-19(14-15)23(28)25(22(17)27)16-8-4-3-5-9-16/h6-7,10-14,16H,2-5,8-9H2,1H3,(H,24,26).
What are the key properties of N-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide?
N-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide has a molecular weight of 392.46 g/mol, XLogP of 4.27, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexyl-1,3-dioxoisoindol-5-yl)-2-ethoxybenzamide is sourced from PubChem (CID 2233800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).