N-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide

C25H26N2O4 — CID 17186678

IUPACN-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide
SMILESCCN(C(=O)c1ccccc1NC(=O)C(C)Oc1ccc(OC)cc1)c1ccccc1
InChIInChI=1S/C25H26N2O4/c1-4-27(19-10-6-5-7-11-19)25(29)22-12-8-9-13-23(22)26-24(28)18(2)31-21-16-14-20(30-3)15-17-21/h5-18H,4H2,1-3H3,(H,26,28)
InChIKeyOQYKTCNFFXUXLH-UHFFFAOYSA-N
MW418.49 g/mol
LogP4.77
Rot. Bonds8

About N-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide

N-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide (PubChem CID 17186678) has the molecular formula C25H26N2O4 and a molecular weight of 418.49 g/mol. Its IUPAC name is N-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide.

Molecular Properties

Compound NameN-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide
PubChem CID17186678
Molecular FormulaC25H26N2O4
Molecular Weight418.49 g/mol
Exact Mass418.19
IUPAC NameN-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide
SMILESCCN(C(=O)c1ccccc1NC(=O)C(C)Oc1ccc(OC)cc1)c1ccccc1
InChIInChI=1S/C25H26N2O4/c1-4-27(19-10-6-5-7-11-19)25(29)22-12-8-9-13-23(22)26-24(28)18(2)31-21-16-14-20(30-3)15-17-21/h5-18H,4H2,1-3H3,(H,26,28)
InChIKeyOQYKTCNFFXUXLH-UHFFFAOYSA-N
XLogP4.77
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.49
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[[(2S)-2-(4-methoxyphenoxy)propanoyl]amino]benzoate
CID 719429
N-(2-benzoylphenyl)-2-(4-methoxyphenoxy)propanamide
CID 132656400
(2R)-2-(4-methoxyphenoxy)-N-(2-methoxyphenyl)propanamide
CID 925101
(2R)-N-(2-ethylsulfanylphenyl)-2-(4-methoxyphenoxy)propanamide
CID 28568404
methyl 2-[2-(4-ethoxyphenoxy)propanoylamino]benzoate
CID 53267145
(2S)-2-(4-methoxyphenoxy)-N-(2-phenoxyphenyl)propanamide
CID 42093263
4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide
CID 17380470
2-(4-methoxyphenoxy)-N-(2-phenoxyphenyl)propanamide
CID 18837904
2-[[(2R)-2-phenoxypropanoyl]amino]benzamide
CID 1336329
N,N-diethyl-2-[2-(3-fluorophenoxy)propanoylamino]benzamide
CID 86835519
N-[4-[ethyl(phenyl)sulfamoyl]phenyl]-2-(4-methoxyphenoxy)propanamide
CID 4942716
N-benzyl-2-[[(2R)-2-phenoxypropanoyl]amino]benzamide
CID 7369012

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide?
The IUPAC name of N-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide (CID 17186678) is N-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide.
What is the SMILES notation for N-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide?
The canonical SMILES for N-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide is CCN(C(=O)c1ccccc1NC(=O)C(C)Oc1ccc(OC)cc1)c1ccccc1.
What is the InChIKey of N-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide?
The InChIKey is OQYKTCNFFXUXLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O4/c1-4-27(19-10-6-5-7-11-19)25(29)22-12-8-9-13-23(22)26-24(28)18(2)31-21-16-14-20(30-3)15-17-21/h5-18H,4H2,1-3H3,(H,26,28).
What are the key properties of N-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide?
N-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide has a molecular weight of 418.49 g/mol, XLogP of 4.77, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenylbenzamide is sourced from PubChem (CID 17186678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).