3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide

C23H24N2O4 — CID 17342290

IUPAC3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide
SMILESO=C(CCC1CCCCC1)Nc1cccc(Oc2ccc3c(c2)C(=O)NC3=O)c1
InChIInChI=1S/C23H24N2O4/c26-21(12-9-15-5-2-1-3-6-15)24-16-7-4-8-17(13-16)29-18-10-11-19-20(14-18)23(28)25-22(19)27/h4,7-8,10-11,13-15H,1-3,5-6,9,12H2,(H,24,26)(H,25,27,28)
InChIKeyPNSFHTQMDZDDSA-UHFFFAOYSA-N
MW392.46 g/mol
LogP4.66
Rot. Bonds6

About 3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide

3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide (PubChem CID 17342290) has the molecular formula C23H24N2O4 and a molecular weight of 392.46 g/mol. Its IUPAC name is 3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide.

Molecular Properties

Compound Name3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide
PubChem CID17342290
Molecular FormulaC23H24N2O4
Molecular Weight392.46 g/mol
Exact Mass392.17
IUPAC Name3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide
SMILESO=C(CCC1CCCCC1)Nc1cccc(Oc2ccc3c(c2)C(=O)NC3=O)c1
InChIInChI=1S/C23H24N2O4/c26-21(12-9-15-5-2-1-3-6-15)24-16-7-4-8-17(13-16)29-18-10-11-19-20(14-18)23(28)25-22(19)27/h4,7-8,10-11,13-15H,1-3,5-6,9,12H2,(H,24,26)(H,25,27,28)
InChIKeyPNSFHTQMDZDDSA-UHFFFAOYSA-N
XLogP4.66
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 54.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-cyclopentyl-N-[4-(3-methylphenoxy)phenyl]propanamide
CID 2446291
N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]-2-(2-methylphenoxy)acetamide
CID 1319335
3-cyclohexyl-N-[3-(propanoylamino)phenyl]propanamide
CID 46568170
N-(3-chlorophenyl)-3-cyclohexylpropanamide
CID 803651
3-(1-cyclohexylpiperidin-4-yl)-N-(3-methoxyphenyl)propanamide
CID 29022201
3-cyclohexyl-N-(6-oxo-5H-benzo[b][1,4]benzothiazepin-8-yl)propanamide
CID 118373527
3-cyclohexyl-N-(3-sulfamoylphenyl)propanamide
CID 4588833
N-[3-(difluoromethoxy)phenyl]-3-piperidin-4-ylpropanamide
CID 62210707
3-cyclopentyl-N-(4-methoxyphenyl)propanamide
CID 835546
ethyl 3-(3-cyclopentylpropanoylamino)benzoate
CID 837279
N-[4-(1,3-dioxoisoindol-5-yl)oxyphenyl]-3-(4-methoxyphenyl)propanamide
CID 17342338
3-[1-(cyclopentanecarbonyl)piperidin-4-yl]-N-(3-methoxyphenyl)propanamide
CID 25453412

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide?
The IUPAC name of 3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide (CID 17342290) is 3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide.
What is the SMILES notation for 3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide?
The canonical SMILES for 3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide is O=C(CCC1CCCCC1)Nc1cccc(Oc2ccc3c(c2)C(=O)NC3=O)c1.
What is the InChIKey of 3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide?
The InChIKey is PNSFHTQMDZDDSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4/c26-21(12-9-15-5-2-1-3-6-15)24-16-7-4-8-17(13-16)29-18-10-11-19-20(14-18)23(28)25-22(19)27/h4,7-8,10-11,13-15H,1-3,5-6,9,12H2,(H,24,26)(H,25,27,28).
What are the key properties of 3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide?
3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide has a molecular weight of 392.46 g/mol, XLogP of 4.66, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]propanamide is sourced from PubChem (CID 17342290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).