4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide

C19H23NO3 — CID 95172520

IUPAC4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide
SMILESCCOc1ccc(C(=O)NCCCc2cccc(OC)c2)cc1
InChIInChI=1S/C19H23NO3/c1-3-23-17-11-9-16(10-12-17)19(21)20-13-5-7-15-6-4-8-18(14-15)22-2/h4,6,8-12,14H,3,5,7,13H2,1-2H3,(H,20,21)
InChIKeyYQOIMUZBGSMLJS-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.46
Rot. Bonds8

About 4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide

4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide (PubChem CID 95172520) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide.

Molecular Properties

Compound Name4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide
PubChem CID95172520
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide
SMILESCCOc1ccc(C(=O)NCCCc2cccc(OC)c2)cc1
InChIInChI=1S/C19H23NO3/c1-3-23-17-11-9-16(10-12-17)19(21)20-13-5-7-15-6-4-8-18(14-15)22-2/h4,6,8-12,14H,3,5,7,13H2,1-2H3,(H,20,21)
InChIKeyYQOIMUZBGSMLJS-UHFFFAOYSA-N
XLogP3.46
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.46
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

2-(4-methoxyphenoxy)-N-[3-(3-methoxyphenyl)propyl]acetamide
CID 95172596
N-[3-(3-methoxyphenyl)propyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 100705004
ethyl [4-[3-[3-(3-methoxyphenyl)propanoylamino]propylcarbamoyl]phenyl] carbonate
CID 108932396
4-(aminomethyl)-N-[2-(3-methoxyphenyl)ethyl]benzamide
CID 103794996
4-chloro-N-[2-(3-methoxyphenyl)ethyl]benzamide
CID 113098173
N-[3-(3-methoxyphenyl)propyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 95172560
1-(3-ethoxyphenyl)-3-[3-(3-methoxyphenyl)propyl]thiourea
CID 100676423
3,5-dibromo-N-[2-(3-methoxyphenyl)ethyl]benzamide
CID 107980616
1-N-[2-(3-methoxyphenyl)ethyl]-4-N-phenylbenzene-1,4-dicarboxamide
CID 109048051
4-N-cycloheptyl-1-N-[2-(3-methoxyphenyl)ethyl]benzene-1,4-dicarboxamide
CID 109048043
2-(4-methoxyphenoxy)-N-[3-(3-methoxyphenyl)propyl]butanamide
CID 132653897
3-ethoxy-N-[3-[(3-ethoxybenzoyl)amino]propyl]benzamide
CID 4958099

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide?
The IUPAC name of 4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide (CID 95172520) is 4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide.
What is the SMILES notation for 4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide?
The canonical SMILES for 4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide is CCOc1ccc(C(=O)NCCCc2cccc(OC)c2)cc1.
What is the InChIKey of 4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide?
The InChIKey is YQOIMUZBGSMLJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-3-23-17-11-9-16(10-12-17)19(21)20-13-5-7-15-6-4-8-18(14-15)22-2/h4,6,8-12,14H,3,5,7,13H2,1-2H3,(H,20,21).
What are the key properties of 4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide?
4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide has a molecular weight of 313.40 g/mol, XLogP of 3.46, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[3-(3-methoxyphenyl)propyl]benzamide is sourced from PubChem (CID 95172520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).