2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide

C20H24N2O4 — CID 113173533

IUPAC2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccc(CCNC(=O)CN(C(C)=O)c2ccc(OC)cc2)cc1
InChIInChI=1S/C20H24N2O4/c1-15(23)22(17-6-10-19(26-3)11-7-17)14-20(24)21-13-12-16-4-8-18(25-2)9-5-16/h4-11H,12-14H2,1-3H3,(H,21,24)
InChIKeyWNRWLEKDPAPVFZ-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.42
Rot. Bonds8

About 2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide

2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide (PubChem CID 113173533) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide
PubChem CID113173533
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccc(CCNC(=O)CN(C(C)=O)c2ccc(OC)cc2)cc1
InChIInChI=1S/C20H24N2O4/c1-15(23)22(17-6-10-19(26-3)11-7-17)14-20(24)21-13-12-16-4-8-18(25-2)9-5-16/h4-11H,12-14H2,1-3H3,(H,21,24)
InChIKeyWNRWLEKDPAPVFZ-UHFFFAOYSA-N
XLogP2.42
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide (CID 113173533) is 2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide is COc1ccc(CCNC(=O)CN(C(C)=O)c2ccc(OC)cc2)cc1.
What is the InChIKey of 2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide?
The InChIKey is WNRWLEKDPAPVFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-15(23)22(17-6-10-19(26-3)11-7-17)14-20(24)21-13-12-16-4-8-18(25-2)9-5-16/h4-11H,12-14H2,1-3H3,(H,21,24).
What are the key properties of 2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide?
2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide has a molecular weight of 356.42 g/mol, XLogP of 2.42, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 113173533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).