N-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide

C20H25NO3 — CID 92673607

IUPACN-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide
SMILESCCOc1ccccc1CCCNC(=O)Cc1ccc(OC)cc1
InChIInChI=1S/C20H25NO3/c1-3-24-19-9-5-4-7-17(19)8-6-14-21-20(22)15-16-10-12-18(23-2)13-11-16/h4-5,7,9-13H,3,6,8,14-15H2,1-2H3,(H,21,22)
InChIKeyVRYUHQOKQZAIHU-UHFFFAOYSA-N
MW327.42 g/mol
LogP3.39
Rot. Bonds9

About N-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide

N-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide (PubChem CID 92673607) has the molecular formula C20H25NO3 and a molecular weight of 327.42 g/mol. Its IUPAC name is N-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide
PubChem CID92673607
Molecular FormulaC20H25NO3
Molecular Weight327.42 g/mol
Exact Mass327.18
IUPAC NameN-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide
SMILESCCOc1ccccc1CCCNC(=O)Cc1ccc(OC)cc1
InChIInChI=1S/C20H25NO3/c1-3-24-19-9-5-4-7-17(19)8-6-14-21-20(22)15-16-10-12-18(23-2)13-11-16/h4-5,7,9-13H,3,6,8,14-15H2,1-2H3,(H,21,22)
InChIKeyVRYUHQOKQZAIHU-UHFFFAOYSA-N
XLogP3.39
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 ≤ 53.39
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

N-[(2-ethoxyphenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 38009470
N-[3-(4-methoxyphenyl)propyl]-3-[(2-phenylacetyl)amino]propanamide
CID 55919627
1-[3-(2-ethoxyphenyl)propyl]-3-(2-methoxyphenyl)urea
CID 100747319
3-(2-ethoxyphenyl)-N-(3-methoxypropyl)propanamide
CID 78805149
N-[3-(4-methoxyphenyl)propyl]-2-(4-phenylphenyl)acetamide
CID 100516355
1-(2,4-dimethoxyphenyl)-3-[3-(2-ethoxyphenyl)propyl]thiourea
CID 100614857
2-(2-chlorophenyl)-N-[3-(4-methoxyphenyl)propyl]acetamide
CID 100632856
3-(2,6-dichlorophenyl)-N-[3-(2-ethoxyphenyl)propyl]propanamide
CID 100601540
N-hexyl-2-(4-methoxyphenyl)acetamide
CID 3649296
3-(2-ethoxyphenyl)-N-pentylpropanamide
CID 78805290
2-(2-ethoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide
CID 16544819
1-(2-ethoxyphenyl)-3-[2-(4-methoxyphenyl)ethyl]urea
CID 971052

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide?
The IUPAC name of N-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide (CID 92673607) is N-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide.
What is the SMILES notation for N-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide?
The canonical SMILES for N-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide is CCOc1ccccc1CCCNC(=O)Cc1ccc(OC)cc1.
What is the InChIKey of N-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide?
The InChIKey is VRYUHQOKQZAIHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO3/c1-3-24-19-9-5-4-7-17(19)8-6-14-21-20(22)15-16-10-12-18(23-2)13-11-16/h4-5,7,9-13H,3,6,8,14-15H2,1-2H3,(H,21,22).
What are the key properties of N-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide?
N-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide has a molecular weight of 327.42 g/mol, XLogP of 3.39, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 92673607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).