N-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide

C25H26N2O6 — CID 19180542

IUPACN-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide
SMILESCCOc1ccc(OCC(=O)Nc2cc(OC)c(NC(=O)c3ccccc3)cc2OC)cc1
InChIInChI=1S/C25H26N2O6/c1-4-32-18-10-12-19(13-11-18)33-16-24(28)26-20-14-23(31-3)21(15-22(20)30-2)27-25(29)17-8-6-5-7-9-17/h5-15H,4,16H2,1-3H3,(H,26,28)(H,27,29)
InChIKeyFAOVYZACESZWCR-UHFFFAOYSA-N
MW450.49 g/mol
LogP4.37
Rot. Bonds10

About N-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide

N-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide (PubChem CID 19180542) has the molecular formula C25H26N2O6 and a molecular weight of 450.49 g/mol. Its IUPAC name is N-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide.

Molecular Properties

Compound NameN-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide
PubChem CID19180542
Molecular FormulaC25H26N2O6
Molecular Weight450.49 g/mol
Exact Mass450.18
IUPAC NameN-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide
SMILESCCOc1ccc(OCC(=O)Nc2cc(OC)c(NC(=O)c3ccccc3)cc2OC)cc1
InChIInChI=1S/C25H26N2O6/c1-4-32-18-10-12-19(13-11-18)33-16-24(28)26-20-14-23(31-3)21(15-22(20)30-2)27-25(29)17-8-6-5-7-9-17/h5-15H,4,16H2,1-3H3,(H,26,28)(H,27,29)
InChIKeyFAOVYZACESZWCR-UHFFFAOYSA-N
XLogP4.37
TPSA95.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.49
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2,5-dimethoxy-4-[[2-(4-propylphenoxy)acetyl]amino]phenyl]benzamide
CID 19180504
N-[4-[[2-(4-bromo-3-methylphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide
CID 19180524
N-[4-[3-(4-ethoxyphenyl)prop-2-enoylamino]-2,5-dimethoxyphenyl]benzamide
CID 4642812
N-(4-benzamido-2,5-dimethoxyphenyl)benzamide
CID 1053126
N-[4-[2-(2-methoxyanilino)-2-oxoethoxy]phenyl]benzamide
CID 9252851
N-(4-benzamido-2,5-diethoxyphenyl)benzamide
CID 1147279
N-[4-[[2-(4-bromo-2,6-dimethylphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide
CID 19180537
4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide
CID 46323186
N-[4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide
CID 19180531
ethyl 4-(4-benzamido-2,5-dimethoxyanilino)-4-oxobutanoate
CID 9087779
N-[2,5-dimethoxy-4-[4-(4-propylphenoxy)butanoylamino]phenyl]benzamide
CID 19191483
N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3-methoxy-4-[2-(2-methoxyanilino)-2-oxoethoxy]benzamide
CID 3554862

Frequently Asked Questions

What is the IUPAC name of N-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide?
The IUPAC name of N-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide (CID 19180542) is N-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide.
What is the SMILES notation for N-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide?
The canonical SMILES for N-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide is CCOc1ccc(OCC(=O)Nc2cc(OC)c(NC(=O)c3ccccc3)cc2OC)cc1.
What is the InChIKey of N-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide?
The InChIKey is FAOVYZACESZWCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O6/c1-4-32-18-10-12-19(13-11-18)33-16-24(28)26-20-14-23(31-3)21(15-22(20)30-2)27-25(29)17-8-6-5-7-9-17/h5-15H,4,16H2,1-3H3,(H,26,28)(H,27,29).
What are the key properties of N-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide?
N-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide has a molecular weight of 450.49 g/mol, XLogP of 4.37, 10 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[2-(4-ethoxyphenoxy)acetyl]amino]-2,5-dimethoxyphenyl]benzamide is sourced from PubChem (CID 19180542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).