N-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide

C20H24N2O3 — CID 9437519

IUPACN-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide
SMILESCc1ccc(OCC(=O)N(C)CC(=O)Nc2c(C)cccc2C)cc1
InChIInChI=1S/C20H24N2O3/c1-14-8-10-17(11-9-14)25-13-19(24)22(4)12-18(23)21-20-15(2)6-5-7-16(20)3/h5-11H,12-13H2,1-4H3,(H,21,23)
InChIKeyAOYBRHCDANFCIG-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.09
Rot. Bonds6

About N-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide

N-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide (PubChem CID 9437519) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide
PubChem CID9437519
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide
SMILESCc1ccc(OCC(=O)N(C)CC(=O)Nc2c(C)cccc2C)cc1
InChIInChI=1S/C20H24N2O3/c1-14-8-10-17(11-9-14)25-13-19(24)22(4)12-18(23)21-20-15(2)6-5-7-16(20)3/h5-11H,12-13H2,1-4H3,(H,21,23)
InChIKeyAOYBRHCDANFCIG-UHFFFAOYSA-N
XLogP3.09
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide?
The IUPAC name of N-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide (CID 9437519) is N-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide is Cc1ccc(OCC(=O)N(C)CC(=O)Nc2c(C)cccc2C)cc1.
What is the InChIKey of N-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide?
The InChIKey is AOYBRHCDANFCIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-14-8-10-17(11-9-14)25-13-19(24)22(4)12-18(23)21-20-15(2)6-5-7-16(20)3/h5-11H,12-13H2,1-4H3,(H,21,23).
What are the key properties of N-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide?
N-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide has a molecular weight of 340.42 g/mol, XLogP of 3.09, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide is sourced from PubChem (CID 9437519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).