N-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide

C26H28N2O5 — CID 53266069

IUPACN-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide
SMILESCCc1ccc(OC(C)C(=O)Nc2cc(OC)c(NC(=O)c3ccccc3)cc2OC)cc1
InChIInChI=1S/C26H28N2O5/c1-5-18-11-13-20(14-12-18)33-17(2)25(29)27-21-15-24(32-4)22(16-23(21)31-3)28-26(30)19-9-7-6-8-10-19/h6-17H,5H2,1-4H3,(H,27,29)(H,28,30)
InChIKeyHYMOWGTWDWBKOE-UHFFFAOYSA-N
MW448.52 g/mol
LogP4.92
Rot. Bonds9

About N-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide

N-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide (PubChem CID 53266069) has the molecular formula C26H28N2O5 and a molecular weight of 448.52 g/mol. Its IUPAC name is N-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide.

Molecular Properties

Compound NameN-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide
PubChem CID53266069
Molecular FormulaC26H28N2O5
Molecular Weight448.52 g/mol
Exact Mass448.20
IUPAC NameN-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide
SMILESCCc1ccc(OC(C)C(=O)Nc2cc(OC)c(NC(=O)c3ccccc3)cc2OC)cc1
InChIInChI=1S/C26H28N2O5/c1-5-18-11-13-20(14-12-18)33-17(2)25(29)27-21-15-24(32-4)22(16-23(21)31-3)28-26(30)19-9-7-6-8-10-19/h6-17H,5H2,1-4H3,(H,27,29)(H,28,30)
InChIKeyHYMOWGTWDWBKOE-UHFFFAOYSA-N
XLogP4.92
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500448.52
LogP ≤ 54.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[2-(4-ethylphenoxy)propanoylamino]-2-methylphenyl]benzamide
CID 54781731
N-[2,5-diethoxy-4-[2-(4-fluorophenoxy)propanoylamino]phenyl]benzamide
CID 43008457
N-[2,5-dimethoxy-4-(2-methylpentanoylamino)phenyl]benzamide
CID 4035607
N-(4-benzamido-2,5-dimethoxyphenyl)benzamide
CID 1053126
4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide
CID 17380470
2-(4-ethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 17093767
N-(3-chloro-4-methoxyphenyl)-4-[1-(4-ethylanilino)-1-oxopropan-2-yl]oxybenzamide
CID 2968265
N-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide
CID 4953273
(2R)-N-(2-bromophenyl)-2-(4-ethylphenoxy)propanamide
CID 9236709
N-[4-(2-aminopentanoylamino)-2,5-dimethoxyphenyl]benzamide
CID 119265950
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-ethylphenoxy)propanamide
CID 53266077
2-(4-ethylphenoxy)-N-naphthalen-1-ylpropanamide
CID 4953259

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide?
The IUPAC name of N-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide (CID 53266069) is N-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide.
What is the SMILES notation for N-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide?
The canonical SMILES for N-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide is CCc1ccc(OC(C)C(=O)Nc2cc(OC)c(NC(=O)c3ccccc3)cc2OC)cc1.
What is the InChIKey of N-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide?
The InChIKey is HYMOWGTWDWBKOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28N2O5/c1-5-18-11-13-20(14-12-18)33-17(2)25(29)27-21-15-24(32-4)22(16-23(21)31-3)28-26(30)19-9-7-6-8-10-19/h6-17H,5H2,1-4H3,(H,27,29)(H,28,30).
What are the key properties of N-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide?
N-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide has a molecular weight of 448.52 g/mol, XLogP of 4.92, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide is sourced from PubChem (CID 53266069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).