2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide

C20H24N2O4 — CID 26713943

IUPAC2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide
SMILESCOc1cccc(C(=O)NCC(=O)Nc2c(C)cc(C)cc2C)c1OC
InChIInChI=1S/C20H24N2O4/c1-12-9-13(2)18(14(3)10-12)22-17(23)11-21-20(24)15-7-6-8-16(25-4)19(15)26-5/h6-10H,11H2,1-5H3,(H,21,24)(H,22,23)
InChIKeyHJPRTXXGOVHRDQ-UHFFFAOYSA-N
MW356.42 g/mol
LogP3.00
Rot. Bonds6

About 2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide

2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide (PubChem CID 26713943) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide.

Molecular Properties

Compound Name2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide
PubChem CID26713943
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide
SMILESCOc1cccc(C(=O)NCC(=O)Nc2c(C)cc(C)cc2C)c1OC
InChIInChI=1S/C20H24N2O4/c1-12-9-13(2)18(14(3)10-12)22-17(23)11-21-20(24)15-7-6-8-16(25-4)19(15)26-5/h6-10H,11H2,1-5H3,(H,21,24)(H,22,23)
InChIKeyHJPRTXXGOVHRDQ-UHFFFAOYSA-N
XLogP3.00
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide?
The IUPAC name of 2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide (CID 26713943) is 2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide.
What is the SMILES notation for 2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide?
The canonical SMILES for 2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide is COc1cccc(C(=O)NCC(=O)Nc2c(C)cc(C)cc2C)c1OC.
What is the InChIKey of 2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide?
The InChIKey is HJPRTXXGOVHRDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-12-9-13(2)18(14(3)10-12)22-17(23)11-21-20(24)15-7-6-8-16(25-4)19(15)26-5/h6-10H,11H2,1-5H3,(H,21,24)(H,22,23).
What are the key properties of 2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide?
2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide has a molecular weight of 356.42 g/mol, XLogP of 3.00, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide is sourced from PubChem (CID 26713943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).