2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide

C13H19NO5 — CID 115139976

IUPAC2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide
SMILESCOc1cc(OC)c(CN(C)C(=O)CO)c(OC)c1
InChIInChI=1S/C13H19NO5/c1-14(13(16)8-15)7-10-11(18-3)5-9(17-2)6-12(10)19-4/h5-6,15H,7-8H2,1-4H3
InChIKeyVPZGPAQGTZJLLK-UHFFFAOYSA-N
MW269.30 g/mol
LogP0.66
Rot. Bonds6

About 2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide

2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide (PubChem CID 115139976) has the molecular formula C13H19NO5 and a molecular weight of 269.30 g/mol. Its IUPAC name is 2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide
PubChem CID115139976
Molecular FormulaC13H19NO5
Molecular Weight269.30 g/mol
Exact Mass269.13
IUPAC Name2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide
SMILESCOc1cc(OC)c(CN(C)C(=O)CO)c(OC)c1
InChIInChI=1S/C13H19NO5/c1-14(13(16)8-15)7-10-11(18-3)5-9(17-2)6-12(10)19-4/h5-6,15H,7-8H2,1-4H3
InChIKeyVPZGPAQGTZJLLK-UHFFFAOYSA-N
XLogP0.66
TPSA68.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2,4-dimethoxyphenyl)methyl]-2-hydroxy-N-methylacetamide
CID 94687468
2-cyano-N-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylacetamide
CID 115173226
2-hydroxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylacetamide
CID 115140024
N-[(3,4-dimethoxyphenyl)methyl]-2-hydroxy-N-methylacetamide
CID 14117549
N-[(5-fluoro-2-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide
CID 82128249
N-[(2,5-dimethoxy-3,4-dimethylphenyl)methyl]-2-hydroxy-N-methylacetamide
CID 115140029
N'-methyl-N'-[(2,4,6-trimethoxyphenyl)methyl]ethane-1,2-diamine
CID 55103553
N-methyl-3-(2,4,6-trimethoxyphenyl)propanehydrazide
CID 116844991
N-[(3-fluoro-4-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide
CID 82128248
N-[(3-tert-butyl-4-methoxyphenyl)methyl]-2-hydroxy-N-methylacetamide
CID 115139923
3-[methyl-[(2,4,6-trimethoxyphenyl)methyl]amino]propanenitrile
CID 115231000
N-[(2,4-dimethoxyphenyl)methyl]-N-methyl-3-methylsulfanylpropanamide
CID 112790479

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide?
The IUPAC name of 2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide (CID 115139976) is 2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide is COc1cc(OC)c(CN(C)C(=O)CO)c(OC)c1.
What is the InChIKey of 2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide?
The InChIKey is VPZGPAQGTZJLLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO5/c1-14(13(16)8-15)7-10-11(18-3)5-9(17-2)6-12(10)19-4/h5-6,15H,7-8H2,1-4H3.
What are the key properties of 2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide?
2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide has a molecular weight of 269.30 g/mol, XLogP of 0.66, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide is sourced from PubChem (CID 115139976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).