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

C19H22N2O4 — CID 26904107

IUPACN-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide
SMILESCOc1ccc(OCC(=O)NCC(=O)Nc2c(C)cccc2C)cc1
InChIInChI=1S/C19H22N2O4/c1-13-5-4-6-14(2)19(13)21-17(22)11-20-18(23)12-25-16-9-7-15(24-3)8-10-16/h4-10H,11-12H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyXKHDOUGGJWCIKW-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.45
Rot. Bonds7

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

N-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide (PubChem CID 26904107) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide
PubChem CID26904107
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide
SMILESCOc1ccc(OCC(=O)NCC(=O)Nc2c(C)cccc2C)cc1
InChIInChI=1S/C19H22N2O4/c1-13-5-4-6-14(2)19(13)21-17(22)11-20-18(23)12-25-16-9-7-15(24-3)8-10-16/h4-10H,11-12H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyXKHDOUGGJWCIKW-UHFFFAOYSA-N
XLogP2.45
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide?
The IUPAC name of N-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide (CID 26904107) is N-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide is COc1ccc(OCC(=O)NCC(=O)Nc2c(C)cccc2C)cc1.
What is the InChIKey of N-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide?
The InChIKey is XKHDOUGGJWCIKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-13-5-4-6-14(2)19(13)21-17(22)11-20-18(23)12-25-16-9-7-15(24-3)8-10-16/h4-10H,11-12H2,1-3H3,(H,20,23)(H,21,22).
What are the key properties of N-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide?
N-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide has a molecular weight of 342.40 g/mol, XLogP of 2.45, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide is sourced from PubChem (CID 26904107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).