N-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide

C16H25NO3 — CID 108795737

IUPACN-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide
SMILESCCOCCCNC(=O)CCOc1ccc(CC)cc1
InChIInChI=1S/C16H25NO3/c1-3-14-6-8-15(9-7-14)20-13-10-16(18)17-11-5-12-19-4-2/h6-9H,3-5,10-13H2,1-2H3,(H,17,18)
InChIKeyXLQSVKMOTKBYKD-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.56
Rot. Bonds10

About N-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide

N-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide (PubChem CID 108795737) has the molecular formula C16H25NO3 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide.

Molecular Properties

Compound NameN-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide
PubChem CID108795737
Molecular FormulaC16H25NO3
Molecular Weight279.38 g/mol
Exact Mass279.18
IUPAC NameN-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide
SMILESCCOCCCNC(=O)CCOc1ccc(CC)cc1
InChIInChI=1S/C16H25NO3/c1-3-14-6-8-15(9-7-14)20-13-10-16(18)17-11-5-12-19-4-2/h6-9H,3-5,10-13H2,1-2H3,(H,17,18)
InChIKeyXLQSVKMOTKBYKD-UHFFFAOYSA-N
XLogP2.56
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.56
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-decyl-3-(4-ethylphenoxy)propanamide
CID 108795844
N-(3-aminopropyl)-3-(4-ethylphenoxy)propanamide
CID 110834162
N-(3-ethoxypropyl)-3-(4-ethylphenyl)propanamide
CID 78794718
N-[3-(dimethylamino)propyl]-3-(4-ethylphenoxy)propanamide
CID 108795819
3-ethoxy-N'-[2-(4-ethylphenoxy)acetyl]propanehydrazide
CID 17357896
N-(3-ethoxypropyl)-2-(4-propanoylphenoxy)acetamide
CID 78760477
N'-(4-butoxyphenyl)-N-(3-ethoxypropyl)oxamide
CID 126262180
ethyl 4-(3-phenoxypropanoylamino)butanoate
CID 60637552
ethyl 4-[2-(4-ethylphenoxy)ethylcarbamoyl]piperazine-1-carboxylate
CID 112972060
N-(3-ethoxypropyl)-2-(4-nitrophenoxy)acetamide
CID 27680554
4-(4-ethylphenoxy)-N-(4-ethylphenyl)butanamide
CID 19173503
4-(4-ethoxyphenoxy)-N-[2-(methylamino)ethyl]butanamide
CID 119500483

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide?
The IUPAC name of N-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide (CID 108795737) is N-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide.
What is the SMILES notation for N-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide?
The canonical SMILES for N-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide is CCOCCCNC(=O)CCOc1ccc(CC)cc1.
What is the InChIKey of N-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide?
The InChIKey is XLQSVKMOTKBYKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO3/c1-3-14-6-8-15(9-7-14)20-13-10-16(18)17-11-5-12-19-4-2/h6-9H,3-5,10-13H2,1-2H3,(H,17,18).
What are the key properties of N-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide?
N-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide has a molecular weight of 279.38 g/mol, XLogP of 2.56, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxypropyl)-3-(4-ethylphenoxy)propanamide is sourced from PubChem (CID 108795737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).