2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide

C25H26N2O4 — CID 4943270

IUPAC2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide
SMILESCOc1ccccc1OC(C)C(=O)Nc1ccccc1C(=O)NC(C)c1ccccc1
InChIInChI=1S/C25H26N2O4/c1-17(19-11-5-4-6-12-19)26-25(29)20-13-7-8-14-21(20)27-24(28)18(2)31-23-16-10-9-15-22(23)30-3/h4-18H,1-3H3,(H,26,29)(H,27,28)
InChIKeyYCPROLJDXVMZKK-UHFFFAOYSA-N
MW418.49 g/mol
LogP4.59
Rot. Bonds8

About 2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide

2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide (PubChem CID 4943270) has the molecular formula C25H26N2O4 and a molecular weight of 418.49 g/mol. Its IUPAC name is 2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide.

Molecular Properties

Compound Name2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide
PubChem CID4943270
Molecular FormulaC25H26N2O4
Molecular Weight418.49 g/mol
Exact Mass418.19
IUPAC Name2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide
SMILESCOc1ccccc1OC(C)C(=O)Nc1ccccc1C(=O)NC(C)c1ccccc1
InChIInChI=1S/C25H26N2O4/c1-17(19-11-5-4-6-12-19)26-25(29)20-13-7-8-14-21(20)27-24(28)18(2)31-23-16-10-9-15-22(23)30-3/h4-18H,1-3H3,(H,26,29)(H,27,28)
InChIKeyYCPROLJDXVMZKK-UHFFFAOYSA-N
XLogP4.59
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.49
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide
CID 29448293
2-[(2-methoxyphenyl)carbamoylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 100747177
2-[[(2R)-2-(2,3-dimethylphenoxy)propanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide
CID 38008079
2-[[(2S)-2-(4-fluorophenoxy)propanoyl]amino]-N-[(1S)-1-phenylethyl]benzamide
CID 26242811
2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide
CID 42426832
3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide
CID 92674914
2-[3-(2-methoxyphenyl)prop-2-enoylamino]-N-(1-phenylethyl)benzamide
CID 4935071
(2R)-N-[(1S)-1-(4-fluorophenyl)ethyl]-2-(2-methoxyphenoxy)propanamide
CID 99132204
2-[3-[(2-methoxybenzoyl)amino]propanoylamino]-N-(1-phenylethyl)benzamide
CID 43000358
[2-oxo-2-[2-(1-phenylethylcarbamoyl)anilino]ethyl] 2,6-dimethoxybenzoate
CID 42971973
2-[2-[(3-methoxyphenyl)methoxy]propanoylamino]-N-(1-phenylethyl)benzamide
CID 43077572
N-(1-phenylethyl)-2-[(2-propan-2-yloxybenzoyl)carbamothioylamino]benzamide
CID 17045880

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide?
The IUPAC name of 2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide (CID 4943270) is 2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide.
What is the SMILES notation for 2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide?
The canonical SMILES for 2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide is COc1ccccc1OC(C)C(=O)Nc1ccccc1C(=O)NC(C)c1ccccc1.
What is the InChIKey of 2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide?
The InChIKey is YCPROLJDXVMZKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O4/c1-17(19-11-5-4-6-12-19)26-25(29)20-13-7-8-14-21(20)27-24(28)18(2)31-23-16-10-9-15-22(23)30-3/h4-18H,1-3H3,(H,26,29)(H,27,28).
What are the key properties of 2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide?
2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide has a molecular weight of 418.49 g/mol, XLogP of 4.59, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide is sourced from PubChem (CID 4943270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).