3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide

C12H17NO4 — CID 79675926

IUPAC3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide
SMILESCOCCONC(=O)CCc1ccccc1O
InChIInChI=1S/C12H17NO4/c1-16-8-9-17-13-12(15)7-6-10-4-2-3-5-11(10)14/h2-5,14H,6-9H2,1H3,(H,13,15)
InChIKeyXARXUYZRRPRDIW-UHFFFAOYSA-N
MW239.27 g/mol
LogP1.02
Rot. Bonds7

About 3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide

3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide (PubChem CID 79675926) has the molecular formula C12H17NO4 and a molecular weight of 239.27 g/mol. Its IUPAC name is 3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide.

Molecular Properties

Compound Name3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide
PubChem CID79675926
Molecular FormulaC12H17NO4
Molecular Weight239.27 g/mol
Exact Mass239.12
IUPAC Name3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide
SMILESCOCCONC(=O)CCc1ccccc1O
InChIInChI=1S/C12H17NO4/c1-16-8-9-17-13-12(15)7-6-10-4-2-3-5-11(10)14/h2-5,14H,6-9H2,1H3,(H,13,15)
InChIKeyXARXUYZRRPRDIW-UHFFFAOYSA-N
XLogP1.02
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-hydroxyphenyl)-N-(2-methoxyethoxy)acetamide
CID 79679652
N-(2-methoxyethoxy)-3-phenylpropanamide
CID 79676400
methyl 2-[3-(2-hydroxyphenyl)propanoylamino]propanoate
CID 60712354
2-[2-(methylaminooxy)ethyl]phenol
CID 105433402
2-[2-(2-methoxyethoxyamino)-2-oxoethyl]benzoic acid
CID 104601734
3-(4-fluorophenyl)-N-(2-methoxyethoxy)propanamide
CID 79676858
2-(2-hydroxyphenyl)ethyl methyl carbonate
CID 102381478
N-ethoxy-3-(2-methylphenyl)propanamide
CID 63290155
3-(2-chlorophenyl)-N-(2-phenoxyethoxy)propanamide
CID 110632928
3-(2-hydroxyphenyl)-N-[1-[3-methoxy-4-(2-methoxyethoxy)phenyl]ethyl]propanamide
CID 55797839
2,6-dihydroxy-N-(2-methoxyethoxy)benzamide
CID 103890596
3-(3,4-difluorophenyl)-N-(2-methoxyethoxy)propanamide
CID 79676471

Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide?
The IUPAC name of 3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide (CID 79675926) is 3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide.
What is the SMILES notation for 3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide?
The canonical SMILES for 3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide is COCCONC(=O)CCc1ccccc1O.
What is the InChIKey of 3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide?
The InChIKey is XARXUYZRRPRDIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO4/c1-16-8-9-17-13-12(15)7-6-10-4-2-3-5-11(10)14/h2-5,14H,6-9H2,1H3,(H,13,15).
What are the key properties of 3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide?
3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide has a molecular weight of 239.27 g/mol, XLogP of 1.02, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide is sourced from PubChem (CID 79675926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).