2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide

C12H17NO4 — CID 78820291

IUPAC2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide
SMILESCOc1ccc(OC)c(CC(=O)NCCO)c1
InChIInChI=1S/C12H17NO4/c1-16-10-3-4-11(17-2)9(7-10)8-12(15)13-5-6-14/h3-4,7,14H,5-6,8H2,1-2H3,(H,13,15)
InChIKeyXODQQJZAWRRGFA-UHFFFAOYSA-N
MW239.27 g/mol
LogP0.35
Rot. Bonds6

About 2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide

2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide (PubChem CID 78820291) has the molecular formula C12H17NO4 and a molecular weight of 239.27 g/mol. Its IUPAC name is 2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide
PubChem CID78820291
Molecular FormulaC12H17NO4
Molecular Weight239.27 g/mol
Exact Mass239.12
IUPAC Name2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide
SMILESCOc1ccc(OC)c(CC(=O)NCCO)c1
InChIInChI=1S/C12H17NO4/c1-16-10-3-4-11(17-2)9(7-10)8-12(15)13-5-6-14/h3-4,7,14H,5-6,8H2,1-2H3,(H,13,15)
InChIKeyXODQQJZAWRRGFA-UHFFFAOYSA-N
XLogP0.35
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,4-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide
CID 43389932
2-(2,5-dimethoxyphenyl)-N-methoxyacetamide
CID 78829398
N-(2-hydroxyethyl)-2-(2-methoxyphenyl)acetamide
CID 43388864
2-(2,5-dimethoxyphenyl)-N-[2-(ethylamino)-2-oxoethyl]acetamide
CID 78823018
2-chloro-N-[2-[[2-(2,5-dimethoxyphenyl)acetyl]amino]ethyl]benzamide
CID 78868092
2-(2,5-dimethoxyphenyl)-N-[4-(4-methylphenoxy)butyl]acetamide
CID 78882858
2-(2,5-dimethoxyphenyl)-N-[2-(4-methylphenyl)sulfanylethyl]acetamide
CID 78811294
2-(2,5-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]acetamide
CID 78806562
N-(2-hydroxyethyl)-2,4-dimethoxybenzamide
CID 43389009
1-N,4-N-bis[(2,5-dimethoxyphenyl)methyl]benzene-1,4-dicarboxamide
CID 46542093
2-(2,5-dimethoxyphenyl)-N-(2-piperazin-1-ylethyl)acetamide
CID 119446777
2-(2,5-dimethoxyphenyl)-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]acetamide
CID 78892262

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide?
The IUPAC name of 2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide (CID 78820291) is 2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for 2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for 2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide is COc1ccc(OC)c(CC(=O)NCCO)c1.
What is the InChIKey of 2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide?
The InChIKey is XODQQJZAWRRGFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO4/c1-16-10-3-4-11(17-2)9(7-10)8-12(15)13-5-6-14/h3-4,7,14H,5-6,8H2,1-2H3,(H,13,15).
What are the key properties of 2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide?
2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide has a molecular weight of 239.27 g/mol, XLogP of 0.35, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 78820291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).