3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide

C11H14BrNO3 — CID 43427786

IUPAC3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide
SMILESO=C(CCOc1ccc(Br)cc1)NCCO
InChIInChI=1S/C11H14BrNO3/c12-9-1-3-10(4-2-9)16-8-5-11(15)13-6-7-14/h1-4,14H,5-8H2,(H,13,15)
InChIKeyWGRDMQOURSPWKC-UHFFFAOYSA-N
MW288.14 g/mol
LogP1.33
Rot. Bonds6

About 3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide

3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide (PubChem CID 43427786) has the molecular formula C11H14BrNO3 and a molecular weight of 288.14 g/mol. Its IUPAC name is 3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide.

Molecular Properties

Compound Name3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide
PubChem CID43427786
Molecular FormulaC11H14BrNO3
Molecular Weight288.14 g/mol
Exact Mass287.02
IUPAC Name3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide
SMILESO=C(CCOc1ccc(Br)cc1)NCCO
InChIInChI=1S/C11H14BrNO3/c12-9-1-3-10(4-2-9)16-8-5-11(15)13-6-7-14/h1-4,14H,5-8H2,(H,13,15)
InChIKeyWGRDMQOURSPWKC-UHFFFAOYSA-N
XLogP1.33
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.14
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-bromophenoxy)-N-(4-hydroxy-2,2-dimethylbutyl)propanamide
CID 103825257
3-(4-bromophenoxy)-N-(2-bromoprop-2-enyl)propanamide
CID 47438875
3-(4-bromophenoxy)-N-(3-hydroxy-4-methoxybutyl)propanamide
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3-(4-bromophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]propanamide
CID 115362467
7-amino-N-[2-(4-bromophenoxy)ethyl]heptanamide
CID 119757498
3-(4-bromophenoxy)-N-[1-(hydroxymethyl)cyclopropyl]propanamide
CID 115877589
3-(4-bromophenoxy)-N-(1-hydroxypropan-2-yl)propanamide
CID 43427807
3-(4-fluorophenoxy)-N-(5-hydroxypentyl)propanamide
CID 107318784
N-[2-(2-hydroxyethoxy)ethyl]-3-phenoxypropanamide
CID 60654485
2-(4-bromophenoxy)-N-(5-hydroxypentyl)acetamide
CID 107319029
3-(4-bromoanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide
CID 109031057
3-(4-bromophenoxy)-N-(1H-1,2,4-triazol-5-ylmethyl)propanamide
CID 54884764

Frequently Asked Questions

What is the IUPAC name of 3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide?
The IUPAC name of 3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide (CID 43427786) is 3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide.
What is the SMILES notation for 3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide?
The canonical SMILES for 3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide is O=C(CCOc1ccc(Br)cc1)NCCO.
What is the InChIKey of 3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide?
The InChIKey is WGRDMQOURSPWKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrNO3/c12-9-1-3-10(4-2-9)16-8-5-11(15)13-6-7-14/h1-4,14H,5-8H2,(H,13,15).
What are the key properties of 3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide?
3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide has a molecular weight of 288.14 g/mol, XLogP of 1.33, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-bromophenoxy)-N-(2-hydroxyethyl)propanamide is sourced from PubChem (CID 43427786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).