2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide

C22H23NO3 — CID 19174649

IUPAC2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide
SMILESCc1cccc(C)c1OCC(=O)NCCOc1cccc2ccccc12
InChIInChI=1S/C22H23NO3/c1-16-7-5-8-17(2)22(16)26-15-21(24)23-13-14-25-20-12-6-10-18-9-3-4-11-19(18)20/h3-12H,13-15H2,1-2H3,(H,23,24)
InChIKeyKCPLPGFYOCCIKB-UHFFFAOYSA-N
MW349.43 g/mol
LogP4.03
Rot. Bonds7

About 2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide

2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide (PubChem CID 19174649) has the molecular formula C22H23NO3 and a molecular weight of 349.43 g/mol. Its IUPAC name is 2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide.

Molecular Properties

Compound Name2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide
PubChem CID19174649
Molecular FormulaC22H23NO3
Molecular Weight349.43 g/mol
Exact Mass349.17
IUPAC Name2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide
SMILESCc1cccc(C)c1OCC(=O)NCCOc1cccc2ccccc12
InChIInChI=1S/C22H23NO3/c1-16-7-5-8-17(2)22(16)26-15-21(24)23-13-14-25-20-12-6-10-18-9-3-4-11-19(18)20/h3-12H,13-15H2,1-2H3,(H,23,24)
InChIKeyKCPLPGFYOCCIKB-UHFFFAOYSA-N
XLogP4.03
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 54.03
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-(2-methylphenoxy)-N-(2-naphthalen-1-yloxyethyl)propanamide
CID 133220515
2-(2,6-dimethylphenoxy)-N-[6-[[2-(2,6-dimethylphenoxy)acetyl]amino]hexyl]acetamide
CID 3463804
N-(2-naphthalen-1-yloxyethyl)-2-(4-nitrophenoxy)acetamide
CID 19174635
methyl 3-[(2-naphthalen-1-yloxyacetyl)amino]propanoate
CID 26635464
2-(2,6-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide
CID 115699812
2-(2-methoxyphenoxy)-N-[2-(2,3,6-trimethylphenoxy)ethyl]acetamide
CID 113101132
N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide
CID 18113601
2-(2-methoxyethylamino)-N-(2-naphthalen-1-yloxyethyl)acetamide;hydrochloride
CID 119738774
N-(3-acetamidopropyl)-2-(2,6-dimethylphenoxy)acetamide
CID 38448955
2,2,2-trifluoro-N-(2-naphthalen-1-yloxyethyl)acetamide
CID 2063074
N-(2-methylnaphthalen-1-yl)-2-naphthalen-1-yloxyacetamide
CID 856175
2-(cyclopropylmethylamino)-N-(2-naphthalen-1-yloxyethyl)acetamide
CID 119738759

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide?
The IUPAC name of 2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide (CID 19174649) is 2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide.
What is the SMILES notation for 2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide?
The canonical SMILES for 2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide is Cc1cccc(C)c1OCC(=O)NCCOc1cccc2ccccc12.
What is the InChIKey of 2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide?
The InChIKey is KCPLPGFYOCCIKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO3/c1-16-7-5-8-17(2)22(16)26-15-21(24)23-13-14-25-20-12-6-10-18-9-3-4-11-19(18)20/h3-12H,13-15H2,1-2H3,(H,23,24).
What are the key properties of 2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide?
2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide has a molecular weight of 349.43 g/mol, XLogP of 4.03, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylphenoxy)-N-(2-naphthalen-1-yloxyethyl)acetamide is sourced from PubChem (CID 19174649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).