N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide

C25H26N2O4 — CID 60535941

IUPACN-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide
SMILESCOc1ccccc1OCC(=O)Nc1cccc(NC(=O)CCc2ccc(C)cc2)c1
InChIInChI=1S/C25H26N2O4/c1-18-10-12-19(13-11-18)14-15-24(28)26-20-6-5-7-21(16-20)27-25(29)17-31-23-9-4-3-8-22(23)30-2/h3-13,16H,14-15,17H2,1-2H3,(H,26,28)(H,27,29)
InChIKeyJFZLKODXSKDFMW-UHFFFAOYSA-N
MW418.49 g/mol
LogP4.59
Rot. Bonds9

About N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide

N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide (PubChem CID 60535941) has the molecular formula C25H26N2O4 and a molecular weight of 418.49 g/mol. Its IUPAC name is N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide.

Molecular Properties

Compound NameN-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide
PubChem CID60535941
Molecular FormulaC25H26N2O4
Molecular Weight418.49 g/mol
Exact Mass418.19
IUPAC NameN-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide
SMILESCOc1ccccc1OCC(=O)Nc1cccc(NC(=O)CCc2ccc(C)cc2)c1
InChIInChI=1S/C25H26N2O4/c1-18-10-12-19(13-11-18)14-15-24(28)26-20-6-5-7-21(16-20)27-25(29)17-31-23-9-4-3-8-22(23)30-2/h3-13,16H,14-15,17H2,1-2H3,(H,26,28)(H,27,29)
InChIKeyJFZLKODXSKDFMW-UHFFFAOYSA-N
XLogP4.59
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
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

N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]propanamide
CID 55865297
2-(2-methoxyphenoxy)-N-(4-methylphenyl)acetamide
CID 675575
N-[3-[[2-(2-chlorophenoxy)acetyl]amino]phenyl]-3-phenylpropanamide
CID 17222861
3-(4-methylphenyl)-N-phenylpropanamide
CID 2995602
2,5-dimethoxy-N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]benzamide
CID 55886827
N-(3-acetylphenyl)-3-(4-methylphenyl)propanamide
CID 17360048
N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-6-methyl-1H-indole-2-carboxamide
CID 60552543
3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]propanamide
CID 55886579
N-[3-[[2-(4-methylanilino)acetyl]amino]phenyl]-3-phenylpropanamide
CID 54814254
1-amino-N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119298259
2-(2-methoxyphenoxy)-N-[6-[(4-methylphenyl)methylamino]pyridazin-3-yl]acetamide
CID 113041108
2-(2-methoxyphenoxy)-N-[3-(2-methylpropoxy)phenyl]acetamide
CID 17079559

Frequently Asked Questions

What is the IUPAC name of N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide?
The IUPAC name of N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide (CID 60535941) is N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide.
What is the SMILES notation for N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide?
The canonical SMILES for N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide is COc1ccccc1OCC(=O)Nc1cccc(NC(=O)CCc2ccc(C)cc2)c1.
What is the InChIKey of N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide?
The InChIKey is JFZLKODXSKDFMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O4/c1-18-10-12-19(13-11-18)14-15-24(28)26-20-6-5-7-21(16-20)27-25(29)17-31-23-9-4-3-8-22(23)30-2/h3-13,16H,14-15,17H2,1-2H3,(H,26,28)(H,27,29).
What are the key properties of N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide?
N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide has a molecular weight of 418.49 g/mol, XLogP of 4.59, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-(4-methylphenyl)propanamide is sourced from PubChem (CID 60535941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).