2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide

C15H23N3O3 — CID 119677951

IUPAC2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide
SMILESCOCCNCC(=O)N(C)CC(=O)Nc1ccc(C)cc1
InChIInChI=1S/C15H23N3O3/c1-12-4-6-13(7-5-12)17-14(19)11-18(2)15(20)10-16-8-9-21-3/h4-7,16H,8-11H2,1-3H3,(H,17,19)
InChIKeyRCATYQSECTYSCP-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.63
Rot. Bonds8

About 2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide

2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide (PubChem CID 119677951) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide
PubChem CID119677951
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide
SMILESCOCCNCC(=O)N(C)CC(=O)Nc1ccc(C)cc1
InChIInChI=1S/C15H23N3O3/c1-12-4-6-13(7-5-12)17-14(19)11-18(2)15(20)10-16-8-9-21-3/h4-7,16H,8-11H2,1-3H3,(H,17,19)
InChIKeyRCATYQSECTYSCP-UHFFFAOYSA-N
XLogP0.63
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide?
The IUPAC name of 2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide (CID 119677951) is 2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide?
The canonical SMILES for 2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide is COCCNCC(=O)N(C)CC(=O)Nc1ccc(C)cc1.
What is the InChIKey of 2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide?
The InChIKey is RCATYQSECTYSCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-12-4-6-13(7-5-12)17-14(19)11-18(2)15(20)10-16-8-9-21-3/h4-7,16H,8-11H2,1-3H3,(H,17,19).
What are the key properties of 2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide?
2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide has a molecular weight of 293.37 g/mol, XLogP of 0.63, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide is sourced from PubChem (CID 119677951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).