2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide

C21H26N2O5 — CID 113174773

IUPAC2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide
SMILESCOc1ccc(N(CC(=O)Nc2ccccc2OC(C)C)C(C)=O)c(OC)c1
InChIInChI=1S/C21H26N2O5/c1-14(2)28-19-9-7-6-8-17(19)22-21(25)13-23(15(3)24)18-11-10-16(26-4)12-20(18)27-5/h6-12,14H,13H2,1-5H3,(H,22,25)
InChIKeyWEUWIYSVVHCTHR-UHFFFAOYSA-N
MW386.45 g/mol
LogP3.48
Rot. Bonds8

About 2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide

2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide (PubChem CID 113174773) has the molecular formula C21H26N2O5 and a molecular weight of 386.45 g/mol. Its IUPAC name is 2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide
PubChem CID113174773
Molecular FormulaC21H26N2O5
Molecular Weight386.45 g/mol
Exact Mass386.18
IUPAC Name2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide
SMILESCOc1ccc(N(CC(=O)Nc2ccccc2OC(C)C)C(C)=O)c(OC)c1
InChIInChI=1S/C21H26N2O5/c1-14(2)28-19-9-7-6-8-17(19)22-21(25)13-23(15(3)24)18-11-10-16(26-4)12-20(18)27-5/h6-12,14H,13H2,1-5H3,(H,22,25)
InChIKeyWEUWIYSVVHCTHR-UHFFFAOYSA-N
XLogP3.48
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(N-acetyl-2-methylanilino)-N-(2-propan-2-yloxyphenyl)acetamide
CID 113167392
2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-ethoxyphenyl)acetamide
CID 113174616
N-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide
CID 113174784
2-(N-acetyl-2-propan-2-yloxyanilino)-N-(2-ethylphenyl)acetamide
CID 113174277
2-(N-acetyl-2,4-dimethoxyanilino)-N-(2,3,4-trifluorophenyl)acetamide
CID 113174807
3-(N-acetyl-2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)propanamide
CID 113130157
3-(N-acetyl-3-methoxyanilino)-N-(2-propan-2-yloxyphenyl)propanamide
CID 113128994
3-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-ylphenyl)propanamide
CID 113130137
2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 113174308
2-(N-acetyl-2,4-dimethoxyanilino)-N-(4-methylphenyl)acetamide
CID 113174733
2-(N-acetyl-3-methylanilino)-N-(2-propan-2-yloxyphenyl)acetamide
CID 113167588
2-[acetyl-[(2-methoxyphenyl)methyl]amino]-N-(2-propan-2-yloxyphenyl)acetamide
CID 113162972

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide (CID 113174773) is 2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide is COc1ccc(N(CC(=O)Nc2ccccc2OC(C)C)C(C)=O)c(OC)c1.
What is the InChIKey of 2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide?
The InChIKey is WEUWIYSVVHCTHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O5/c1-14(2)28-19-9-7-6-8-17(19)22-21(25)13-23(15(3)24)18-11-10-16(26-4)12-20(18)27-5/h6-12,14H,13H2,1-5H3,(H,22,25).
What are the key properties of 2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide?
2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide has a molecular weight of 386.45 g/mol, XLogP of 3.48, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide is sourced from PubChem (CID 113174773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).