3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide

C23H29N3O5 — CID 9219213

IUPAC3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCC(=O)N(C)CC(=O)Nc2c(C)cc(C)cc2C)c1
InChIInChI=1S/C23H29N3O5/c1-14-7-15(2)22(16(3)8-14)25-20(27)13-26(4)21(28)12-24-23(29)17-9-18(30-5)11-19(10-17)31-6/h7-11H,12-13H2,1-6H3,(H,24,29)(H,25,27)
InChIKeyTVEYQULEYOIAFB-UHFFFAOYSA-N
MW427.50 g/mol
LogP2.46
Rot. Bonds8

About 3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide

3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide (PubChem CID 9219213) has the molecular formula C23H29N3O5 and a molecular weight of 427.50 g/mol. Its IUPAC name is 3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide
PubChem CID9219213
Molecular FormulaC23H29N3O5
Molecular Weight427.50 g/mol
Exact Mass427.21
IUPAC Name3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCC(=O)N(C)CC(=O)Nc2c(C)cc(C)cc2C)c1
InChIInChI=1S/C23H29N3O5/c1-14-7-15(2)22(16(3)8-14)25-20(27)13-26(4)21(28)12-24-23(29)17-9-18(30-5)11-19(10-17)31-6/h7-11H,12-13H2,1-6H3,(H,24,29)(H,25,27)
InChIKeyTVEYQULEYOIAFB-UHFFFAOYSA-N
XLogP2.46
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.50
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]carbamate
CID 75415569
3-(3,5-dimethoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]propanamide
CID 9093129
2-[[2-(4-methoxyphenoxy)acetyl]-methylamino]-N-(2,4,6-trimethylphenyl)acetamide
CID 8752660
N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]-2-phenylacetamide
CID 26714971
3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide
CID 18114048
2-amino-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide
CID 119291379
2-[(4-methoxyphenyl)carbamoyl-methylamino]-N-(2,4,6-trimethylphenyl)acetamide
CID 51226266
N-[2-[[2-(3-methoxyanilino)-2-oxoethyl]-methylamino]-2-oxoethyl]-3,4-dimethylbenzamide
CID 9418791
3,4-dimethoxy-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide
CID 7974245
4-bromo-N-[3-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-3-oxopropyl]benzamide
CID 26714808
2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide
CID 30867500
2-methoxy-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide
CID 27783988

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide?
The IUPAC name of 3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide (CID 9219213) is 3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide.
What is the SMILES notation for 3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide?
The canonical SMILES for 3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide is COc1cc(OC)cc(C(=O)NCC(=O)N(C)CC(=O)Nc2c(C)cc(C)cc2C)c1.
What is the InChIKey of 3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide?
The InChIKey is TVEYQULEYOIAFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O5/c1-14-7-15(2)22(16(3)8-14)25-20(27)13-26(4)21(28)12-24-23(29)17-9-18(30-5)11-19(10-17)31-6/h7-11H,12-13H2,1-6H3,(H,24,29)(H,25,27).
What are the key properties of 3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide?
3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide has a molecular weight of 427.50 g/mol, XLogP of 2.46, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 9219213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).