N-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide

C12H17NO5 — CID 114032049

IUPACN-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)Nc1ccc(OC)c(O)c1
InChIInChI=1S/C12H17NO5/c1-16-5-6-18-8-12(15)13-9-3-4-11(17-2)10(14)7-9/h3-4,7,14H,5-6,8H2,1-2H3,(H,13,15)
InChIKeyWGMFNCRDHUJBTO-UHFFFAOYSA-N
MW255.27 g/mol
LogP1.00
Rot. Bonds7

About N-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide

N-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide (PubChem CID 114032049) has the molecular formula C12H17NO5 and a molecular weight of 255.27 g/mol. Its IUPAC name is N-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide.

Molecular Properties

Compound NameN-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide
PubChem CID114032049
Molecular FormulaC12H17NO5
Molecular Weight255.27 g/mol
Exact Mass255.11
IUPAC NameN-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)Nc1ccc(OC)c(O)c1
InChIInChI=1S/C12H17NO5/c1-16-5-6-18-8-12(15)13-9-3-4-11(17-2)10(14)7-9/h3-4,7,14H,5-6,8H2,1-2H3,(H,13,15)
InChIKeyWGMFNCRDHUJBTO-UHFFFAOYSA-N
XLogP1.00
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 ≤ 51.00
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

2-(2-aminoethoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide
CID 79473739
2-(2-methoxyethoxy)-N-[4-methoxy-3-(4-methoxyphenoxy)phenyl]acetamide
CID 30902018
2-(2-ethoxyethoxy)-N-(4-methoxy-3-methylphenyl)acetamide
CID 86839026
2-anilino-N-(3-hydroxy-4-methoxyphenyl)acetamide
CID 60860600
2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide
CID 7478739
N-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride
CID 91844892
4-methoxy-3-[[2-(2-methoxyethoxy)acetyl]amino]benzoic acid
CID 63744788
4-[[2-(2-methoxyethoxy)acetyl]amino]-N-(2-methoxyphenyl)benzamide
CID 43037458
N-(3-hydroxy-4-methoxyphenyl)-2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetamide
CID 7478740
N-(3-hydroxy-4-methoxyphenyl)-2-phenylsulfanylacetamide
CID 7974901
2-(2-methoxyethoxy)-N-(4-propylphenyl)acetamide
CID 103606707
3-amino-N-(3-hydroxy-4-methoxyphenyl)-3-phenylpropanamide
CID 43710838

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide?
The IUPAC name of N-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide (CID 114032049) is N-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide.
What is the SMILES notation for N-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide?
The canonical SMILES for N-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide is COCCOCC(=O)Nc1ccc(OC)c(O)c1.
What is the InChIKey of N-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide?
The InChIKey is WGMFNCRDHUJBTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO5/c1-16-5-6-18-8-12(15)13-9-3-4-11(17-2)10(14)7-9/h3-4,7,14H,5-6,8H2,1-2H3,(H,13,15).
What are the key properties of N-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide?
N-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide has a molecular weight of 255.27 g/mol, XLogP of 1.00, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide is sourced from PubChem (CID 114032049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).