N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide

C17H18FNO3 — CID 18113601

IUPACN-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)NCCOc1ccccc1F
InChIInChI=1S/C17H18FNO3/c1-13-6-2-4-8-15(13)22-12-17(20)19-10-11-21-16-9-5-3-7-14(16)18/h2-9H,10-12H2,1H3,(H,19,20)
InChIKeyCVIZLNSJVXDNMD-UHFFFAOYSA-N
MW303.33 g/mol
LogP2.71
Rot. Bonds7

About N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide

N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide (PubChem CID 18113601) has the molecular formula C17H18FNO3 and a molecular weight of 303.33 g/mol. Its IUPAC name is N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide
PubChem CID18113601
Molecular FormulaC17H18FNO3
Molecular Weight303.33 g/mol
Exact Mass303.13
IUPAC NameN-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)NCCOc1ccccc1F
InChIInChI=1S/C17H18FNO3/c1-13-6-2-4-8-15(13)22-12-17(20)19-10-11-21-16-9-5-3-7-14(16)18/h2-9H,10-12H2,1H3,(H,19,20)
InChIKeyCVIZLNSJVXDNMD-UHFFFAOYSA-N
XLogP2.71
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.33
LogP ≤ 52.71
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-(2,4-dimethylphenoxy)ethyl]-2-(2-fluorophenoxy)acetamide
CID 9011621
2-(2-ethoxyphenoxy)-N-[2-(2-fluorophenoxy)ethyl]acetamide
CID 8961012
3-(2,5-dimethylphenoxy)-N-[2-(2-fluorophenoxy)ethyl]propanamide
CID 7927608
N-[2-(2-hydroxyethoxy)ethyl]-2-(2-methylphenoxy)acetamide
CID 60654502
N-[3-(2-fluorophenoxy)propyl]-2-(2-methoxy-4-methylphenoxy)acetamide
CID 18120320
2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride
CID 119300070
N-[2-(2-methylphenoxy)ethyl]-3-phenylpropanamide
CID 600522
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-(2-fluorophenoxy)acetohydrazide
CID 7943429
2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide
CID 94623553
N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide
CID 34315448
2-(2-methylphenoxy)-N-pentylacetamide
CID 110756249
2-(methylamino)-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride
CID 119742926

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide (CID 18113601) is N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide is Cc1ccccc1OCC(=O)NCCOc1ccccc1F.
What is the InChIKey of N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide?
The InChIKey is CVIZLNSJVXDNMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO3/c1-13-6-2-4-8-15(13)22-12-17(20)19-10-11-21-16-9-5-3-7-14(16)18/h2-9H,10-12H2,1H3,(H,19,20).
What are the key properties of N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide?
N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide has a molecular weight of 303.33 g/mol, XLogP of 2.71, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 18113601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).