N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide

C18H21NO5 — CID 17034633

IUPACN-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide
SMILESCOc1ccc(OCCC(=O)Nc2cc(OC)ccc2OC)cc1
InChIInChI=1S/C18H21NO5/c1-21-13-4-6-14(7-5-13)24-11-10-18(20)19-16-12-15(22-2)8-9-17(16)23-3/h4-9,12H,10-11H2,1-3H3,(H,19,20)
InChIKeyKUNBRJDBSYHBLZ-UHFFFAOYSA-N
MW331.37 g/mol
LogP3.12
Rot. Bonds8

About N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide

N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide (PubChem CID 17034633) has the molecular formula C18H21NO5 and a molecular weight of 331.37 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide
PubChem CID17034633
Molecular FormulaC18H21NO5
Molecular Weight331.37 g/mol
Exact Mass331.14
IUPAC NameN-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide
SMILESCOc1ccc(OCCC(=O)Nc2cc(OC)ccc2OC)cc1
InChIInChI=1S/C18H21NO5/c1-21-13-4-6-14(7-5-13)24-11-10-18(20)19-16-12-15(22-2)8-9-17(16)23-3/h4-9,12H,10-11H2,1-3H3,(H,19,20)
InChIKeyKUNBRJDBSYHBLZ-UHFFFAOYSA-N
XLogP3.12
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.37
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N'-bis(2,5-dimethoxyphenyl)butanediamide
CID 1011774
N-(2,5-dimethoxyphenyl)-2-(4-methoxyphenoxy)acetamide
CID 676177
N-(2,5-dimethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide
CID 2452955
N-[2-methoxy-5-[(2-methoxyphenyl)sulfamoyl]phenyl]-3-(4-methoxyphenoxy)propanamide
CID 24635935
N-(5-tert-butyl-2-methoxyphenyl)-3-phenoxypropanamide
CID 4856932
N-(2,5-dimethoxyphenyl)hexadecanamide
CID 20789890
N-(2-bromo-5-methoxyphenyl)-3-phenoxypropanamide
CID 62416404
N-(2,5-dimethoxyphenyl)-3-[(4-methoxyphenyl)methylamino]propanamide
CID 109022511
N-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide
CID 54820345
2-[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl-N-(2,5-dimethoxyphenyl)acetamide
CID 35495479
N-(2,5-dimethoxyphenyl)-2-[2-(4-ethoxyphenoxy)ethylsulfanyl]acetamide
CID 31544280
N-(2,5-dimethoxyphenyl)-2-[2-(4-propoxyphenoxy)ethylsulfanyl]acetamide
CID 31547774

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide (CID 17034633) is N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide is COc1ccc(OCCC(=O)Nc2cc(OC)ccc2OC)cc1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide?
The InChIKey is KUNBRJDBSYHBLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO5/c1-21-13-4-6-14(7-5-13)24-11-10-18(20)19-16-12-15(22-2)8-9-17(16)23-3/h4-9,12H,10-11H2,1-3H3,(H,19,20).
What are the key properties of N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide?
N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide has a molecular weight of 331.37 g/mol, XLogP of 3.12, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide is sourced from PubChem (CID 17034633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).