N-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide

C12H17NO5 — CID 110678307

IUPACN-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide
SMILESCOc1ccc(NC(=O)COCCO)c(OC)c1
InChIInChI=1S/C12H17NO5/c1-16-9-3-4-10(11(7-9)17-2)13-12(15)8-18-6-5-14/h3-4,7,14H,5-6,8H2,1-2H3,(H,13,15)
InChIKeyVLRAKIMZDLWQTL-UHFFFAOYSA-N
MW255.27 g/mol
LogP0.65
Rot. Bonds7

About N-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide

N-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide (PubChem CID 110678307) has the molecular formula C12H17NO5 and a molecular weight of 255.27 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide
PubChem CID110678307
Molecular FormulaC12H17NO5
Molecular Weight255.27 g/mol
Exact Mass255.11
IUPAC NameN-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide
SMILESCOc1ccc(NC(=O)COCCO)c(OC)c1
InChIInChI=1S/C12H17NO5/c1-16-9-3-4-10(11(7-9)17-2)13-12(15)8-18-6-5-14/h3-4,7,14H,5-6,8H2,1-2H3,(H,13,15)
InChIKeyVLRAKIMZDLWQTL-UHFFFAOYSA-N
XLogP0.65
TPSA77.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2,4-dimethoxyphenyl)-2-(4-methoxyphenoxy)acetamide
CID 868059
N-(2,4-dimethoxyphenyl)-5-hydroxypentanamide
CID 79019431
N-(2,3-dichlorophenyl)-2-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]acetamide
CID 3910876
N-(2,4-dimethoxyphenyl)-2-[2-oxo-2-(N-phenylanilino)ethoxy]acetamide
CID 3376668
2-(3,5-dichlorophenoxy)-N-(2,4-dimethoxyphenyl)acetamide
CID 7467088
3-[3-(2,4-dimethoxyanilino)-3-oxopropyl]sulfanyl-N-(2,4-dimethoxyphenyl)propanamide
CID 2933269
N-(4-methoxy-2-methylphenyl)-2-propoxyacetamide
CID 113230378
N-(2,4-dimethoxyphenyl)-3-(2-methylpropoxy)propanamide
CID 38956787
N-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenoxy)acetamide
CID 7930919
N-(2-amino-4-methoxyphenyl)-2-[2-(2-methoxyethoxy)ethoxy]acetamide
CID 104560142
4-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]-3-methoxybenzoic acid
CID 45397323
2-(2-acetamido-5-acetylphenoxy)-N-(2,4-dimethoxyphenyl)acetamide
CID 24534009

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide (CID 110678307) is N-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide is COc1ccc(NC(=O)COCCO)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide?
The InChIKey is VLRAKIMZDLWQTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO5/c1-16-9-3-4-10(11(7-9)17-2)13-12(15)8-18-6-5-14/h3-4,7,14H,5-6,8H2,1-2H3,(H,13,15).
What are the key properties of N-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide?
N-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide has a molecular weight of 255.27 g/mol, XLogP of 0.65, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide is sourced from PubChem (CID 110678307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).