N-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide

C23H25NO3 — CID 133164555

IUPACN-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide
SMILESCCc1ccc(OCCNC(=O)C(C)Oc2ccc3ccccc3c2)cc1
InChIInChI=1S/C23H25NO3/c1-3-18-8-11-21(12-9-18)26-15-14-24-23(25)17(2)27-22-13-10-19-6-4-5-7-20(19)16-22/h4-13,16-17H,3,14-15H2,1-2H3,(H,24,25)
InChIKeyROGDXGOSDHXCMK-UHFFFAOYSA-N
MW363.46 g/mol
LogP4.36
Rot. Bonds8

About N-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide

N-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide (PubChem CID 133164555) has the molecular formula C23H25NO3 and a molecular weight of 363.46 g/mol. Its IUPAC name is N-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide.

Molecular Properties

Compound NameN-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide
PubChem CID133164555
Molecular FormulaC23H25NO3
Molecular Weight363.46 g/mol
Exact Mass363.18
IUPAC NameN-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide
SMILESCCc1ccc(OCCNC(=O)C(C)Oc2ccc3ccccc3c2)cc1
InChIInChI=1S/C23H25NO3/c1-3-18-8-11-21(12-9-18)26-15-14-24-23(25)17(2)27-22-13-10-19-6-4-5-7-20(19)16-22/h4-13,16-17H,3,14-15H2,1-2H3,(H,24,25)
InChIKeyROGDXGOSDHXCMK-UHFFFAOYSA-N
XLogP4.36
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 54.36
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-(3,4-dimethylphenoxy)-N-[2-(4-ethylphenoxy)ethyl]propanamide
CID 133211029
2-naphthalen-2-yloxy-N-[2-(4-propylphenoxy)ethyl]butanamide
CID 133240086
(2S)-N-[2-(4-ethylphenoxy)ethyl]-2-methyl-3-naphthalen-1-ylpropanamide
CID 100509329
(2S)-2-(3-fluorophenoxy)-N-(2-phenoxyethyl)propanamide
CID 30865784
N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide
CID 45147924
N-[2-(4-morpholin-4-ylsulfonylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide
CID 133234805
N-[2-(4-fluorophenoxy)ethyl]-2-naphthalen-2-yloxybutanamide
CID 133240085
2-(2-ethylphenoxy)-N-(2-phenoxyethyl)propanamide
CID 133239770
N-[2-(4-ethylphenoxy)ethyl]-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)propanamide
CID 133234673
N-[2-(3,4-dimethylphenoxy)ethyl]-2-phenoxypropanamide
CID 133210994
2-(2-methylphenoxy)-N-[2-(4-propylphenoxy)ethyl]propanamide
CID 133239751
(2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide
CID 8949228

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide?
The IUPAC name of N-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide (CID 133164555) is N-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide.
What is the SMILES notation for N-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide?
The canonical SMILES for N-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide is CCc1ccc(OCCNC(=O)C(C)Oc2ccc3ccccc3c2)cc1.
What is the InChIKey of N-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide?
The InChIKey is ROGDXGOSDHXCMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO3/c1-3-18-8-11-21(12-9-18)26-15-14-24-23(25)17(2)27-22-13-10-19-6-4-5-7-20(19)16-22/h4-13,16-17H,3,14-15H2,1-2H3,(H,24,25).
What are the key properties of N-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide?
N-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide has a molecular weight of 363.46 g/mol, XLogP of 4.36, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide is sourced from PubChem (CID 133164555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).