N-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide

C23H24N2O4 — CID 112987885

IUPACN-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide
SMILESCOc1ccc(OC)c(Nc2ccc(NC(=O)COc3ccc(C)cc3)cc2)c1
InChIInChI=1S/C23H24N2O4/c1-16-4-10-19(11-5-16)29-15-23(26)25-18-8-6-17(7-9-18)24-21-14-20(27-2)12-13-22(21)28-3/h4-14,24H,15H2,1-3H3,(H,25,26)
InChIKeyZWHIKSMPPKZTAZ-UHFFFAOYSA-N
MW392.46 g/mol
LogP4.77
Rot. Bonds8

About N-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide

N-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide (PubChem CID 112987885) has the molecular formula C23H24N2O4 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide
PubChem CID112987885
Molecular FormulaC23H24N2O4
Molecular Weight392.46 g/mol
Exact Mass392.17
IUPAC NameN-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide
SMILESCOc1ccc(OC)c(Nc2ccc(NC(=O)COc3ccc(C)cc3)cc2)c1
InChIInChI=1S/C23H24N2O4/c1-16-4-10-19(11-5-16)29-15-23(26)25-18-8-6-17(7-9-18)24-21-14-20(27-2)12-13-22(21)28-3/h4-14,24H,15H2,1-3H3,(H,25,26)
InChIKeyZWHIKSMPPKZTAZ-UHFFFAOYSA-N
XLogP4.77
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 54.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-(2,5-dimethoxyanilino)pyridazin-3-yl]-2-(4-methylphenoxy)acetamide
CID 113048769
2,5-dimethoxy-N-(4-methylphenyl)aniline
CID 171920056
N-(2,5-dimethoxyphenyl)-2-(4-methoxyphenoxy)acetamide
CID 676177
2-(4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 681889
N-[5-(5-chloro-2-methoxyanilino)-2-pyridinyl]-2-(4-methylphenoxy)acetamide
CID 113033839
2-methoxy-N-[4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]acetamide
CID 35333453
N-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide
CID 112987353
2-(2,5-dimethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide
CID 54814050
N-[4-(2-fluoroanilino)phenyl]-2-(4-methylphenoxy)acetamide
CID 112986773
2-(4-chlorophenoxy)-N-[6-(2-methoxy-5-methylanilino)-3-pyridinyl]acetamide
CID 113019773
2-[4-[2-(4-hydroxyanilino)-2-oxoethoxy]phenoxy]-N-(4-methylphenyl)acetamide
CID 71095079
4-methoxy-N-[2-methoxy-5-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]benzamide
CID 46323188

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide?
The IUPAC name of N-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide (CID 112987885) is N-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide.
What is the SMILES notation for N-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide?
The canonical SMILES for N-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide is COc1ccc(OC)c(Nc2ccc(NC(=O)COc3ccc(C)cc3)cc2)c1.
What is the InChIKey of N-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide?
The InChIKey is ZWHIKSMPPKZTAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4/c1-16-4-10-19(11-5-16)29-15-23(26)25-18-8-6-17(7-9-18)24-21-14-20(27-2)12-13-22(21)28-3/h4-14,24H,15H2,1-3H3,(H,25,26).
What are the key properties of N-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide?
N-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide has a molecular weight of 392.46 g/mol, XLogP of 4.77, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide is sourced from PubChem (CID 112987885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).