2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide

C16H15BrFNO2 — CID 42980776

IUPAC2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide
SMILESCC(NC(=O)COc1ccccc1Br)c1ccc(F)cc1
InChIInChI=1S/C16H15BrFNO2/c1-11(12-6-8-13(18)9-7-12)19-16(20)10-21-15-5-3-2-4-14(15)17/h2-9,11H,10H2,1H3,(H,19,20)
InChIKeyLAPNEVRWLNRXTI-UHFFFAOYSA-N
MW352.20 g/mol
LogP3.84
Rot. Bonds5

About 2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide

2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide (PubChem CID 42980776) has the molecular formula C16H15BrFNO2 and a molecular weight of 352.20 g/mol. Its IUPAC name is 2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide
PubChem CID42980776
Molecular FormulaC16H15BrFNO2
Molecular Weight352.20 g/mol
Exact Mass351.03
IUPAC Name2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide
SMILESCC(NC(=O)COc1ccccc1Br)c1ccc(F)cc1
InChIInChI=1S/C16H15BrFNO2/c1-11(12-6-8-13(18)9-7-12)19-16(20)10-21-15-5-3-2-4-14(15)17/h2-9,11H,10H2,1H3,(H,19,20)
InChIKeyLAPNEVRWLNRXTI-UHFFFAOYSA-N
XLogP3.84
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.20
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromophenoxy)-N-[1-(4-ethylphenyl)ethyl]acetamide
CID 17326940
2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide
CID 16546160
2-(2-ethoxyphenoxy)-N-[(1S)-1-(4-fluorophenyl)ethyl]acetamide
CID 7930315
2-(2-bromophenoxy)-N-[(1S)-1-(3,4-dimethylphenyl)ethyl]acetamide
CID 7466805
N-[1-(4-fluorophenyl)ethyl]-2-naphthalen-1-yloxyacetamide
CID 42976197
2-(2-cyanophenoxy)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide
CID 2562613
2-(2-bromophenoxy)-N-butan-2-ylacetamide
CID 19170000
2-(2-bromophenoxy)-N-[(1S)-1-thiophen-2-ylethyl]acetamide
CID 7847611
N-[(1R)-1-(4-bromophenyl)ethyl]-2-(2-propan-2-ylphenoxy)acetamide
CID 8752279
N-[(1S)-1-(2-bromophenyl)ethyl]-2-(4-fluorophenoxy)acetamide
CID 9220031
3-[[2-(2-bromophenoxy)acetyl]amino]butanoic acid
CID 120522773
2-(2-chlorophenoxy)-N-(1-phenylethyl)acetamide
CID 2787215

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide?
The IUPAC name of 2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide (CID 42980776) is 2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide?
The canonical SMILES for 2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide is CC(NC(=O)COc1ccccc1Br)c1ccc(F)cc1.
What is the InChIKey of 2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide?
The InChIKey is LAPNEVRWLNRXTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15BrFNO2/c1-11(12-6-8-13(18)9-7-12)19-16(20)10-21-15-5-3-2-4-14(15)17/h2-9,11H,10H2,1H3,(H,19,20).
What are the key properties of 2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide?
2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide has a molecular weight of 352.20 g/mol, XLogP of 3.84, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide is sourced from PubChem (CID 42980776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).