2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide

C17H17BrFNO2 — CID 43017424

IUPAC2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide
SMILESCC(Oc1ccc(Br)cc1)C(=O)NCCc1ccccc1F
InChIInChI=1S/C17H17BrFNO2/c1-12(22-15-8-6-14(18)7-9-15)17(21)20-11-10-13-4-2-3-5-16(13)19/h2-9,12H,10-11H2,1H3,(H,20,21)
InChIKeyBBTLVFYINXTURB-UHFFFAOYSA-N
MW366.23 g/mol
LogP3.71
Rot. Bonds6

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

2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide (PubChem CID 43017424) has the molecular formula C17H17BrFNO2 and a molecular weight of 366.23 g/mol. Its IUPAC name is 2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide.

Molecular Properties

Compound Name2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide
PubChem CID43017424
Molecular FormulaC17H17BrFNO2
Molecular Weight366.23 g/mol
Exact Mass365.04
IUPAC Name2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide
SMILESCC(Oc1ccc(Br)cc1)C(=O)NCCc1ccccc1F
InChIInChI=1S/C17H17BrFNO2/c1-12(22-15-8-6-14(18)7-9-15)17(21)20-11-10-13-4-2-3-5-16(13)19/h2-9,12H,10-11H2,1H3,(H,20,21)
InChIKeyBBTLVFYINXTURB-UHFFFAOYSA-N
XLogP3.71
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.23
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-fluorophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide
CID 46654879
2-(4-bromophenoxy)-N-[2-(2-fluorophenoxy)ethyl]propanamide
CID 18113570
(2S)-2-(4-bromophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 9391636
2-(4-bromophenoxy)-N-(2-pyridin-2-ylethyl)propanamide
CID 51164070
2-(4-fluorophenoxy)-N-[2-(2-methoxyphenyl)ethyl]propanamide
CID 43003184
4-bromo-N-[2-(2-fluorophenyl)ethyl]benzamide
CID 8636623
N-[(2-fluorophenyl)methyl]-2-(4-hydroxyphenoxy)propanamide
CID 56983513
2-(4-bromophenoxy)-N-[(2-methylphenyl)methyl]propanamide
CID 84929552
2-(4-bromophenoxy)-N-[3-(methylamino)propyl]propanamide
CID 119433897
(2S)-2-(4-bromophenoxy)-N-butylpropanamide
CID 28826027
2-(4-methylphenoxy)-N-[2-(2-methylphenyl)ethyl]propanamide
CID 18114534
(2S)-2-(4-tert-butylphenoxy)-N-[(2-fluorophenyl)methyl]propanamide
CID 8571270

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide?
The IUPAC name of 2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide (CID 43017424) is 2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide.
What is the SMILES notation for 2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide?
The canonical SMILES for 2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide is CC(Oc1ccc(Br)cc1)C(=O)NCCc1ccccc1F.
What is the InChIKey of 2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide?
The InChIKey is BBTLVFYINXTURB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17BrFNO2/c1-12(22-15-8-6-14(18)7-9-15)17(21)20-11-10-13-4-2-3-5-16(13)19/h2-9,12H,10-11H2,1H3,(H,20,21).
What are the key properties of 2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide?
2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide has a molecular weight of 366.23 g/mol, XLogP of 3.71, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide is sourced from PubChem (CID 43017424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).