N-benzyl-N-(4-methoxyphenyl)hexanamide

C20H25NO2 — CID 60594646

IUPACN-benzyl-N-(4-methoxyphenyl)hexanamide
SMILESCCCCCC(=O)N(Cc1ccccc1)c1ccc(OC)cc1
InChIInChI=1S/C20H25NO2/c1-3-4-6-11-20(22)21(16-17-9-7-5-8-10-17)18-12-14-19(23-2)15-13-18/h5,7-10,12-15H,3-4,6,11,16H2,1-2H3
InChIKeyOZDLWJJIYHCSIF-UHFFFAOYSA-N
MW311.43 g/mol
LogP4.81
Rot. Bonds8

About N-benzyl-N-(4-methoxyphenyl)hexanamide

N-benzyl-N-(4-methoxyphenyl)hexanamide (PubChem CID 60594646) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is N-benzyl-N-(4-methoxyphenyl)hexanamide.

Molecular Properties

Compound NameN-benzyl-N-(4-methoxyphenyl)hexanamide
PubChem CID60594646
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC NameN-benzyl-N-(4-methoxyphenyl)hexanamide
SMILESCCCCCC(=O)N(Cc1ccccc1)c1ccc(OC)cc1
InChIInChI=1S/C20H25NO2/c1-3-4-6-11-20(22)21(16-17-9-7-5-8-10-17)18-12-14-19(23-2)15-13-18/h5,7-10,12-15H,3-4,6,11,16H2,1-2H3
InChIKeyOZDLWJJIYHCSIF-UHFFFAOYSA-N
XLogP4.81
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride
CID 119032182
1-N,3-N-dibenzyl-1-N,3-N-bis(4-methoxyphenyl)benzene-1,3-dicarboxamide
CID 10144171
N-benzyl-3-(1,3-dioxoisoindol-2-yl)-N-(4-methoxyphenyl)propanamide
CID 55385096
N-benzyl-5-hydroxy-N-phenylpentanamide
CID 79194764
N-benzyl-N-[4-[2-(4-methoxyanilino)-2-oxoethyl]phenyl]propanamide
CID 46045773
2-amino-N-benzyl-N-(4-methoxyphenyl)butanamide;hydrochloride
CID 75429738
N-benzyl-4-hydroxy-N-phenylbutanamide
CID 79191710
N-ethyl-N-phenyloctadecanamide
CID 151424183
N-benzyl-4-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]-N-phenylbutanamide
CID 16885143
2-(N-butanoyl-4-methoxyanilino)acetic acid
CID 28765925
N-ethyl-5-(4-methoxyphenyl)-5-oxo-N-phenylpentanamide
CID 110298239
N-benzyl-4-fluoro-N-(4-methoxyphenyl)benzamide
CID 3724237

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(4-methoxyphenyl)hexanamide?
The IUPAC name of N-benzyl-N-(4-methoxyphenyl)hexanamide (CID 60594646) is N-benzyl-N-(4-methoxyphenyl)hexanamide.
What is the SMILES notation for N-benzyl-N-(4-methoxyphenyl)hexanamide?
The canonical SMILES for N-benzyl-N-(4-methoxyphenyl)hexanamide is CCCCCC(=O)N(Cc1ccccc1)c1ccc(OC)cc1.
What is the InChIKey of N-benzyl-N-(4-methoxyphenyl)hexanamide?
The InChIKey is OZDLWJJIYHCSIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2/c1-3-4-6-11-20(22)21(16-17-9-7-5-8-10-17)18-12-14-19(23-2)15-13-18/h5,7-10,12-15H,3-4,6,11,16H2,1-2H3.
What are the key properties of N-benzyl-N-(4-methoxyphenyl)hexanamide?
N-benzyl-N-(4-methoxyphenyl)hexanamide has a molecular weight of 311.43 g/mol, XLogP of 4.81, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(4-methoxyphenyl)hexanamide is sourced from PubChem (CID 60594646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).