N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide

C20H24FNO2 — CID 110297832

IUPACN-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide
SMILESCOc1ccc(CCCCC(=O)NCCc2ccc(F)cc2)cc1
InChIInChI=1S/C20H24FNO2/c1-24-19-12-8-16(9-13-19)4-2-3-5-20(23)22-15-14-17-6-10-18(21)11-7-17/h6-13H,2-5,14-15H2,1H3,(H,22,23)
InChIKeyPITZGDCIEUOUFD-UHFFFAOYSA-N
MW329.42 g/mol
LogP3.91
Rot. Bonds9

About N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide

N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide (PubChem CID 110297832) has the molecular formula C20H24FNO2 and a molecular weight of 329.42 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide
PubChem CID110297832
Molecular FormulaC20H24FNO2
Molecular Weight329.42 g/mol
Exact Mass329.18
IUPAC NameN-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide
SMILESCOc1ccc(CCCCC(=O)NCCc2ccc(F)cc2)cc1
InChIInChI=1S/C20H24FNO2/c1-24-19-12-8-16(9-13-19)4-2-3-5-20(23)22-15-14-17-6-10-18(21)11-7-17/h6-13H,2-5,14-15H2,1H3,(H,22,23)
InChIKeyPITZGDCIEUOUFD-UHFFFAOYSA-N
XLogP3.91
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.42
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]butanamide
CID 110297665
3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 18107472
N-[2-(4-fluorophenyl)ethyl]-3-[(4-methoxyphenyl)methylamino]propanamide
CID 109022421
4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide
CID 79017762
N-(3-acetamidopropyl)-5-(4-methoxyphenyl)pentanamide
CID 110309527
5-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide
CID 110297842
4-chloro-N-[2-(4-methoxyphenyl)ethyl]butanamide
CID 3613637
5-(4-methoxyphenyl)-N-(3-methylbutyl)pentanamide
CID 110297852
N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-5-(4-fluorophenyl)pentanamide
CID 110302068
N-[2-(4-fluorophenyl)ethyl]-4-(methylamino)butanamide;hydrochloride
CID 119675755
N-[2-(4-fluorophenyl)ethyl]-N'-(4-methoxyphenyl)propanediamide
CID 108948446
N-(3-aminopropyl)-6-(4-methoxyphenyl)hexanamide;hydrochloride
CID 119406247

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide?
The IUPAC name of N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide (CID 110297832) is N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide?
The canonical SMILES for N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide is COc1ccc(CCCCC(=O)NCCc2ccc(F)cc2)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide?
The InChIKey is PITZGDCIEUOUFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FNO2/c1-24-19-12-8-16(9-13-19)4-2-3-5-20(23)22-15-14-17-6-10-18(21)11-7-17/h6-13H,2-5,14-15H2,1H3,(H,22,23).
What are the key properties of N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide?
N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide has a molecular weight of 329.42 g/mol, XLogP of 3.91, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide is sourced from PubChem (CID 110297832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).