5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide

C20H23NO5 — CID 110311300

IUPAC5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide
SMILESCOc1ccc(C(=O)CCCC(=O)NOCCOc2ccccc2)cc1
InChIInChI=1S/C20H23NO5/c1-24-17-12-10-16(11-13-17)19(22)8-5-9-20(23)21-26-15-14-25-18-6-3-2-4-7-18/h2-4,6-7,10-13H,5,8-9,14-15H2,1H3,(H,21,23)
InChIKeyOIMZQXDCXFYNDM-UHFFFAOYSA-N
MW357.41 g/mol
LogP3.17
Rot. Bonds11

About 5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide

5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide (PubChem CID 110311300) has the molecular formula C20H23NO5 and a molecular weight of 357.41 g/mol. Its IUPAC name is 5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide.

Molecular Properties

Compound Name5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide
PubChem CID110311300
Molecular FormulaC20H23NO5
Molecular Weight357.41 g/mol
Exact Mass357.16
IUPAC Name5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide
SMILESCOc1ccc(C(=O)CCCC(=O)NOCCOc2ccccc2)cc1
InChIInChI=1S/C20H23NO5/c1-24-17-12-10-16(11-13-17)19(22)8-5-9-20(23)21-26-15-14-25-18-6-3-2-4-7-18/h2-4,6-7,10-13H,5,8-9,14-15H2,1H3,(H,21,23)
InChIKeyOIMZQXDCXFYNDM-UHFFFAOYSA-N
XLogP3.17
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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

4-methoxy-N-(2-phenoxyethoxy)benzamide
CID 110294662
N-methoxy-5-(4-methoxyphenyl)-5-oxopentanamide
CID 47413820
4-(4-fluorophenyl)-4-oxo-N-(2-phenoxyethoxy)butanamide
CID 110311296
5-(4-methoxyphenyl)-N-[4-(4-methylphenoxy)butyl]-5-oxopentanamide
CID 55972820
N-(4-anilinophenyl)-5-(4-methoxyphenyl)-5-oxopentanamide
CID 52710157
N-(2-amino-2-phenylethyl)-5-(4-methoxyphenyl)-5-oxopentanamide;hydrochloride
CID 119528324
2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide
CID 110632975
4-(3-methoxyphenoxy)-1-phenylbutan-1-one
CID 43218335
N-(2-methoxyethoxy)-4-(4-methylphenoxy)butanamide
CID 79676685
N-[(1R)-1-hydroxy-1-[4-[2-(4-methoxyphenoxy)ethoxy]phenyl]propan-2-yl]-6-(4-methoxyphenyl)-6-oxohexanamide
CID 118983873
2-(2-methoxyphenoxy)-N-(2-phenoxyethoxy)acetamide
CID 110294693
N-[(4-methoxyphenyl)methyl]-4-phenoxybutanamide
CID 2569863

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide?
The IUPAC name of 5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide (CID 110311300) is 5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide.
What is the SMILES notation for 5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide?
The canonical SMILES for 5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide is COc1ccc(C(=O)CCCC(=O)NOCCOc2ccccc2)cc1.
What is the InChIKey of 5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide?
The InChIKey is OIMZQXDCXFYNDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO5/c1-24-17-12-10-16(11-13-17)19(22)8-5-9-20(23)21-26-15-14-25-18-6-3-2-4-7-18/h2-4,6-7,10-13H,5,8-9,14-15H2,1H3,(H,21,23).
What are the key properties of 5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide?
5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide has a molecular weight of 357.41 g/mol, XLogP of 3.17, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide is sourced from PubChem (CID 110311300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).