4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide

C26H22N2O4 — CID 56508453

IUPAC4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide
SMILESO=C(Nc1cccc(N2C(=O)c3ccccc3C2=O)c1)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C26H22N2O4/c29-24(17-12-14-21(15-13-17)32-20-8-1-2-9-20)27-18-6-5-7-19(16-18)28-25(30)22-10-3-4-11-23(22)26(28)31/h3-7,10-16,20H,1-2,8-9H2,(H,27,29)
InChIKeyIMXKHDSTTQSLDP-UHFFFAOYSA-N
MW426.47 g/mol
LogP5.06
Rot. Bonds5

About 4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide

4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide (PubChem CID 56508453) has the molecular formula C26H22N2O4 and a molecular weight of 426.47 g/mol. Its IUPAC name is 4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide
PubChem CID56508453
Molecular FormulaC26H22N2O4
Molecular Weight426.47 g/mol
Exact Mass426.16
IUPAC Name4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide
SMILESO=C(Nc1cccc(N2C(=O)c3ccccc3C2=O)c1)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C26H22N2O4/c29-24(17-12-14-21(15-13-17)32-20-8-1-2-9-20)27-18-6-5-7-19(16-18)28-25(30)22-10-3-4-11-23(22)26(28)31/h3-7,10-16,20H,1-2,8-9H2,(H,27,29)
InChIKeyIMXKHDSTTQSLDP-UHFFFAOYSA-N
XLogP5.06
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500426.47
LogP ≤ 55.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]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

cyclohexyl 4-[[3-(1,3-dioxoisoindol-2-yl)benzoyl]amino]benzoate
CID 19177393
N-[3-(1,3-dioxoisoindol-2-yl)phenyl]-4-pyrrol-1-ylbenzamide
CID 56507056
N-[3-(1,3-dioxoisoindol-2-yl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
CID 56507697
4-(2-amino-2-oxoethoxy)-N-(3-cyclopentyloxyphenyl)benzamide
CID 36546121
N-[3-(1,3-dioxoisoindol-2-yl)phenyl]-4-(ethylsulfanylmethyl)benzamide
CID 56507674
3-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]propanamide
CID 56508213
N-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide
CID 46585132
3-(1,3-dioxoisoindol-2-yl)-N-(4-propan-2-yloxyphenyl)benzamide
CID 19177383
2-(4-acetylphenoxy)-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]acetamide
CID 56507840
4-(1,3-dioxoisoindol-2-yl)-N-(3-methylsulfanylphenyl)benzamide
CID 9402903
6-chloro-N-(3-cyclopentyloxyphenyl)pyridine-3-carboxamide
CID 46579918
N-(4-cyclopentyloxyphenyl)pyridine-4-carboxamide;hydrochloride
CID 110777040

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide?
The IUPAC name of 4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide (CID 56508453) is 4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide.
What is the SMILES notation for 4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide?
The canonical SMILES for 4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide is O=C(Nc1cccc(N2C(=O)c3ccccc3C2=O)c1)c1ccc(OC2CCCC2)cc1.
What is the InChIKey of 4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide?
The InChIKey is IMXKHDSTTQSLDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N2O4/c29-24(17-12-14-21(15-13-17)32-20-8-1-2-9-20)27-18-6-5-7-19(16-18)28-25(30)22-10-3-4-11-23(22)26(28)31/h3-7,10-16,20H,1-2,8-9H2,(H,27,29).
What are the key properties of 4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide?
4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide has a molecular weight of 426.47 g/mol, XLogP of 5.06, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyloxy-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzamide is sourced from PubChem (CID 56508453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).