N-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide

C23H24N2O4 — CID 51268360

IUPACN-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide
SMILESCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)N(C)C1CCCC1
InChIInChI=1S/C23H24N2O4/c1-24(16-7-3-4-8-16)21(26)19-13-15(11-12-20(19)29-2)14-25-22(27)17-9-5-6-10-18(17)23(25)28/h5-6,9-13,16H,3-4,7-8,14H2,1-2H3
InChIKeySZTWWGMMMOXCTH-UHFFFAOYSA-N
MW392.46 g/mol
LogP3.51
Rot. Bonds5

About N-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide

N-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide (PubChem CID 51268360) has the molecular formula C23H24N2O4 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide.

Molecular Properties

Compound NameN-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide
PubChem CID51268360
Molecular FormulaC23H24N2O4
Molecular Weight392.46 g/mol
Exact Mass392.17
IUPAC NameN-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide
SMILESCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)N(C)C1CCCC1
InChIInChI=1S/C23H24N2O4/c1-24(16-7-3-4-8-16)21(26)19-13-15(11-12-20(19)29-2)14-25-22(27)17-9-5-6-10-18(17)23(25)28/h5-6,9-13,16H,3-4,7-8,14H2,1-2H3
InChIKeySZTWWGMMMOXCTH-UHFFFAOYSA-N
XLogP3.51
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-cyclohexyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-ethoxy-N-methylbenzamide
CID 27670598
N-cyclopropyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-[(4-methoxyphenyl)methyl]benzamide
CID 55388015
2-[[3-(4-cyclopentylpiperazine-1-carbonyl)-4-methoxyphenyl]methyl]isoindole-1,3-dione
CID 55584263
N-cyclohexyl-5-[(4-hydroxy-2-oxo-1,3-thiazol-3-yl)methyl]-2-methoxy-N-methylbenzamide
CID 90762207
N-[(3-chlorophenyl)methyl]-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide
CID 26893001
5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-[(4-methylphenyl)methyl]benzamide
CID 7916782
N-benzyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxybenzamide
CID 7945607
2-methoxyethyl 5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxybenzoate
CID 46541751
[2-oxo-2-[[(2R)-oxolan-2-yl]methylamino]ethyl] 5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxybenzoate
CID 2667928
2-[[3-[(2S,6R)-2,6-dimethylmorpholine-4-carbonyl]-4-methoxyphenyl]methyl]isoindole-1,3-dione
CID 27660661
ethyl 2-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxybenzoyl]-(2-methoxyethyl)amino]acetate
CID 55726676
N-cyclopentyl-3-methoxy-N-methylnaphthalene-2-carboxamide
CID 30394493

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide?
The IUPAC name of N-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide (CID 51268360) is N-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide.
What is the SMILES notation for N-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide?
The canonical SMILES for N-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide is COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)N(C)C1CCCC1.
What is the InChIKey of N-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide?
The InChIKey is SZTWWGMMMOXCTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4/c1-24(16-7-3-4-8-16)21(26)19-13-15(11-12-20(19)29-2)14-25-22(27)17-9-5-6-10-18(17)23(25)28/h5-6,9-13,16H,3-4,7-8,14H2,1-2H3.
What are the key properties of N-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide?
N-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide has a molecular weight of 392.46 g/mol, XLogP of 3.51, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-methylbenzamide is sourced from PubChem (CID 51268360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).