2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide

C14H17BrFNO2 — CID 83233705

IUPAC2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide
SMILESCC(Oc1ccc(F)c(Br)c1)C(=O)NC1CCCC1
InChIInChI=1S/C14H17BrFNO2/c1-9(14(18)17-10-4-2-3-5-10)19-11-6-7-13(16)12(15)8-11/h6-10H,2-5H2,1H3,(H,17,18)
InChIKeyLOPREUDSNCIHGV-UHFFFAOYSA-N
MW330.20 g/mol
LogP3.41
Rot. Bonds4

About 2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide

2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide (PubChem CID 83233705) has the molecular formula C14H17BrFNO2 and a molecular weight of 330.20 g/mol. Its IUPAC name is 2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide.

Molecular Properties

Compound Name2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide
PubChem CID83233705
Molecular FormulaC14H17BrFNO2
Molecular Weight330.20 g/mol
Exact Mass329.04
IUPAC Name2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide
SMILESCC(Oc1ccc(F)c(Br)c1)C(=O)NC1CCCC1
InChIInChI=1S/C14H17BrFNO2/c1-9(14(18)17-10-4-2-3-5-10)19-11-6-7-13(16)12(15)8-11/h6-10H,2-5H2,1H3,(H,17,18)
InChIKeyLOPREUDSNCIHGV-UHFFFAOYSA-N
XLogP3.41
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.20
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromo-3-methylphenoxy)-N-cyclohexylpropanamide
CID 83133628
N-cyclopentyl-2-[3-fluoro-4-(1-hydroxyethyl)phenoxy]propanamide
CID 107719756
N-cyclooctyl-2-(4-fluorophenoxy)propanamide
CID 42909316
(2S)-N-cycloheptyl-2-(7-methoxynaphthalen-2-yl)oxypropanamide
CID 40855971
(2R)-2-(3-chloro-4-fluorophenoxy)-N-cyclopropylpropanamide
CID 7751160
2-(3-bromophenoxy)-N-cyclopentylpropanamide
CID 43082983
2-(2-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide
CID 43083012
(2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide
CID 2706554
2-(4-bromo-3,5-dimethylphenoxy)-N-cyclopentylpropanamide
CID 107723816
(2S)-N-cyclopentyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 100702405
N-cyclohexyl-2-[4-(4-fluorobenzoyl)phenoxy]propanamide
CID 4817669
4-[2-(3,4-difluorophenoxy)propanoylamino]cyclohexane-1-carboxylic acid
CID 119229245

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide?
The IUPAC name of 2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide (CID 83233705) is 2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide.
What is the SMILES notation for 2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide?
The canonical SMILES for 2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide is CC(Oc1ccc(F)c(Br)c1)C(=O)NC1CCCC1.
What is the InChIKey of 2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide?
The InChIKey is LOPREUDSNCIHGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17BrFNO2/c1-9(14(18)17-10-4-2-3-5-10)19-11-6-7-13(16)12(15)8-11/h6-10H,2-5H2,1H3,(H,17,18).
What are the key properties of 2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide?
2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide has a molecular weight of 330.20 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide is sourced from PubChem (CID 83233705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).