N-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide

C20H24N2O4 — CID 31973261

IUPACN-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide
SMILESCOc1ccc(NC(=O)CN(C)C(=O)CCc2cccc(OC)c2)cc1
InChIInChI=1S/C20H24N2O4/c1-22(14-19(23)21-16-8-10-17(25-2)11-9-16)20(24)12-7-15-5-4-6-18(13-15)26-3/h4-6,8-11,13H,7,12,14H2,1-3H3,(H,21,23)
InChIKeyGILOQESLIVMOLY-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.73
Rot. Bonds8

About N-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide

N-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide (PubChem CID 31973261) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide.

Molecular Properties

Compound NameN-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide
PubChem CID31973261
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide
SMILESCOc1ccc(NC(=O)CN(C)C(=O)CCc2cccc(OC)c2)cc1
InChIInChI=1S/C20H24N2O4/c1-22(14-19(23)21-16-8-10-17(25-2)11-9-16)20(24)12-7-15-5-4-6-18(13-15)26-3/h4-6,8-11,13H,7,12,14H2,1-3H3,(H,21,23)
InChIKeyGILOQESLIVMOLY-UHFFFAOYSA-N
XLogP2.73
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 ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide?
The IUPAC name of N-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide (CID 31973261) is N-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide.
What is the SMILES notation for N-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide?
The canonical SMILES for N-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide is COc1ccc(NC(=O)CN(C)C(=O)CCc2cccc(OC)c2)cc1.
What is the InChIKey of N-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide?
The InChIKey is GILOQESLIVMOLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-22(14-19(23)21-16-8-10-17(25-2)11-9-16)20(24)12-7-15-5-4-6-18(13-15)26-3/h4-6,8-11,13H,7,12,14H2,1-3H3,(H,21,23).
What are the key properties of N-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide?
N-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide has a molecular weight of 356.42 g/mol, XLogP of 2.73, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyanilino)-2-oxoethyl]-3-(3-methoxyphenyl)-N-methylpropanamide is sourced from PubChem (CID 31973261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).