5-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]pentanamide

C20H25NO3 — CID 110297825

IUPAC5-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]pentanamide
SMILESCOc1ccc(CCCCC(=O)NCc2ccccc2OC)cc1
InChIInChI=1S/C20H25NO3/c1-23-18-13-11-16(12-14-18)7-3-6-10-20(22)21-15-17-8-4-5-9-19(17)24-2/h4-5,8-9,11-14H,3,6-7,10,15H2,1-2H3,(H,21,22)
InChIKeyIUNPITGCOUQWHH-UHFFFAOYSA-N
MW327.42 g/mol
LogP3.73
Rot. Bonds9

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

5-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]pentanamide (PubChem CID 110297825) has the molecular formula C20H25NO3 and a molecular weight of 327.42 g/mol. Its IUPAC name is 5-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]pentanamide.

Molecular Properties

Compound Name5-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]pentanamide
PubChem CID110297825
Molecular FormulaC20H25NO3
Molecular Weight327.42 g/mol
Exact Mass327.18
IUPAC Name5-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]pentanamide
SMILESCOc1ccc(CCCCC(=O)NCc2ccccc2OC)cc1
InChIInChI=1S/C20H25NO3/c1-23-18-13-11-16(12-14-18)7-3-6-10-20(22)21-15-17-8-4-5-9-19(17)24-2/h4-5,8-9,11-14H,3,6-7,10,15H2,1-2H3,(H,21,22)
InChIKeyIUNPITGCOUQWHH-UHFFFAOYSA-N
XLogP3.73
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.42
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(4-chlorophenyl)-N-[(2-methoxyphenyl)methyl]butanamide
CID 110297627
N-[[2-(hydroxymethyl)phenyl]methyl]-3-(4-methoxyphenyl)propanamide
CID 110902384
N-[(2-methoxyphenyl)methyl]-3-pyridin-4-ylpropanamide
CID 110468458
N-[(2-chlorophenyl)methyl]-3-(4-methoxyphenyl)propanamide
CID 2397896
N-[(2,3-dimethoxyphenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 46590636
N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide
CID 110297832
N-[(2-ethoxyphenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 38009470
[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl] 2-(4-methoxyphenoxy)acetate
CID 8905581
4-(3,4-dimethoxyphenyl)-N-[(4-methoxyphenyl)methyl]butanamide
CID 110410210
2-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 808183
N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-5-(4-methoxyphenyl)pentanamide
CID 110305545
2-(7-methoxynaphthalen-2-yl)oxy-N-[(2-methoxyphenyl)methyl]acetamide
CID 7652672

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]pentanamide?
The IUPAC name of 5-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]pentanamide (CID 110297825) is 5-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]pentanamide.
What is the SMILES notation for 5-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]pentanamide?
The canonical SMILES for 5-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]pentanamide is COc1ccc(CCCCC(=O)NCc2ccccc2OC)cc1.
What is the InChIKey of 5-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]pentanamide?
The InChIKey is IUNPITGCOUQWHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO3/c1-23-18-13-11-16(12-14-18)7-3-6-10-20(22)21-15-17-8-4-5-9-19(17)24-2/h4-5,8-9,11-14H,3,6-7,10,15H2,1-2H3,(H,21,22).
What are the key properties of 5-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]pentanamide?
5-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]pentanamide has a molecular weight of 327.42 g/mol, XLogP of 3.73, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]pentanamide is sourced from PubChem (CID 110297825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).