2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide

C14H21NO4 — CID 82725203

IUPAC2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCOc1ccc(CC(=O)NOC(C)(C)C)cc1OC
InChIInChI=1S/C14H21NO4/c1-14(2,3)19-15-13(16)9-10-6-7-11(17-4)12(8-10)18-5/h6-8H,9H2,1-5H3,(H,15,16)
InChIKeyPOTTVDSYRZVLJP-UHFFFAOYSA-N
MW267.32 g/mol
LogP2.09
Rot. Bonds5

About 2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide

2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide (PubChem CID 82725203) has the molecular formula C14H21NO4 and a molecular weight of 267.32 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide
PubChem CID82725203
Molecular FormulaC14H21NO4
Molecular Weight267.32 g/mol
Exact Mass267.15
IUPAC Name2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCOc1ccc(CC(=O)NOC(C)(C)C)cc1OC
InChIInChI=1S/C14H21NO4/c1-14(2,3)19-15-13(16)9-10-6-7-11(17-4)12(8-10)18-5/h6-8H,9H2,1-5H3,(H,15,16)
InChIKeyPOTTVDSYRZVLJP-UHFFFAOYSA-N
XLogP2.09
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

methyl 3-(3,4-dimethoxyphenyl)-2-oxopropanoate
CID 15852024
N-(4-amino-2,2-dimethylbutyl)-2-(3,4-dimethoxyphenyl)acetamide
CID 106140185
N-(4-tert-butylphenyl)-2-(3,4-dimethoxyphenyl)acetamide
CID 7741769
2-(3,4-dimethoxyphenyl)-N'-[2-(4-methoxyanilino)acetyl]acetohydrazide
CID 55350938
tert-butyl N-[1-amino-3-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-1-oxopropan-2-yl]carbamate
CID 66741733
N'-acetyl-2-(3,4-dimethoxyphenyl)acetohydrazide
CID 799227
2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide
CID 113091742
2-(3,4-dimethoxyphenyl)-N-[3-(methylamino)propyl]acetamide
CID 43600817
N-(2-amino-4,5-dimethoxyphenyl)-2-(3,4-dimethoxyphenyl)acetamide
CID 28867945
2-(3,4-dimethoxyphenyl)-N-[[4-(2-methoxyethoxy)phenyl]methyl]acetamide
CID 55662830
2-(3,4-dimethoxyphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
CID 27052353
N-(2-amino-2-ethylbutyl)-2-(3,4-dimethoxyphenyl)acetamide;hydrochloride
CID 119641340

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide (CID 82725203) is 2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide is COc1ccc(CC(=O)NOC(C)(C)C)cc1OC.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide?
The InChIKey is POTTVDSYRZVLJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO4/c1-14(2,3)19-15-13(16)9-10-6-7-11(17-4)12(8-10)18-5/h6-8H,9H2,1-5H3,(H,15,16).
What are the key properties of 2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide?
2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide has a molecular weight of 267.32 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide is sourced from PubChem (CID 82725203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).