4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide

C23H20N2O4 — CID 91678072

IUPAC4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccc(N3Cc4ccccc4C3=O)cc2OC)cc1
InChIInChI=1S/C23H20N2O4/c1-28-18-10-7-15(8-11-18)22(26)24-20-12-9-17(13-21(20)29-2)25-14-16-5-3-4-6-19(16)23(25)27/h3-13H,14H2,1-2H3,(H,24,26)
InChIKeyFUUXRBSFLTUOCP-UHFFFAOYSA-N
MW388.42 g/mol
LogP4.12
Rot. Bonds5

About 4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide

4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide (PubChem CID 91678072) has the molecular formula C23H20N2O4 and a molecular weight of 388.42 g/mol. Its IUPAC name is 4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide
PubChem CID91678072
Molecular FormulaC23H20N2O4
Molecular Weight388.42 g/mol
Exact Mass388.14
IUPAC Name4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccc(N3Cc4ccccc4C3=O)cc2OC)cc1
InChIInChI=1S/C23H20N2O4/c1-28-18-10-7-15(8-11-18)22(26)24-20-12-9-17(13-21(20)29-2)25-14-16-5-3-4-6-19(16)23(25)27/h3-13H,14H2,1-2H3,(H,24,26)
InChIKeyFUUXRBSFLTUOCP-UHFFFAOYSA-N
XLogP4.12
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.42
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-dimethoxyphenyl)-4-pyrrol-1-ylbenzamide
CID 24536376
N-(2,4-dimethoxyphenyl)-4-phenylbenzamide
CID 602380
4-amino-N-(2,4-dimethoxyphenyl)benzamide
CID 8566750
2-[3-(dimethylamino)-4-methoxyphenyl]-3H-isoindol-1-one
CID 25267017
N-[[4-(3-oxo-1H-isoindol-2-yl)phenyl]carbamothioyl]-4-propan-2-yloxybenzamide
CID 54859968
N-(2,4-dimethoxyphenyl)-4-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)benzamide
CID 3866755
2-(3-cyclopentyloxy-4-methoxyphenyl)-N-(1,3-dioxoisoindol-2-yl)-3-oxo-1H-isoindole-5-carboxamide
CID 142665259
(2S)-N-(2,4-dimethoxyphenyl)-2-(3-oxo-1H-isoindol-2-yl)-3-phenylpropanamide
CID 20862776
3,4-dichloro-N-[4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide
CID 54858216
4-[(3aR,4S,7aR)-4-methyl-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(2,4-dimethoxyphenyl)benzamide
CID 11947039
(3S)-N-(4-benzamido-2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 42588888
N-(3,5-dimethoxyphenyl)-4-(1,3-dioxoisoindol-2-yl)benzamide
CID 9096856

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide?
The IUPAC name of 4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide (CID 91678072) is 4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide?
The canonical SMILES for 4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide is COc1ccc(C(=O)Nc2ccc(N3Cc4ccccc4C3=O)cc2OC)cc1.
What is the InChIKey of 4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide?
The InChIKey is FUUXRBSFLTUOCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O4/c1-28-18-10-7-15(8-11-18)22(26)24-20-12-9-17(13-21(20)29-2)25-14-16-5-3-4-6-19(16)23(25)27/h3-13H,14H2,1-2H3,(H,24,26).
What are the key properties of 4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide?
4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide has a molecular weight of 388.42 g/mol, XLogP of 4.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[2-methoxy-4-(3-oxo-1H-isoindol-2-yl)phenyl]benzamide is sourced from PubChem (CID 91678072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).