2-(2-bromophenoxy)ethanamine

C8H10BrNO — CID 22688745

IUPAC2-(2-bromophenoxy)ethanamine
SMILESNCCOc1ccccc1Br
InChIInChI=1S/C8H10BrNO/c9-7-3-1-2-4-8(7)11-6-5-10/h1-4H,5-6,10H2
InChIKeyUWRFNXLTMNVOTG-UHFFFAOYSA-N
MW216.08 g/mol
LogP1.79
Rot. Bonds3

About 2-(2-bromophenoxy)ethanamine

2-(2-bromophenoxy)ethanamine (PubChem CID 22688745) has the molecular formula C8H10BrNO and a molecular weight of 216.08 g/mol. Its IUPAC name is 2-(2-bromophenoxy)ethanamine.

Molecular Properties

Compound Name2-(2-bromophenoxy)ethanamine
PubChem CID22688745
Molecular FormulaC8H10BrNO
Molecular Weight216.08 g/mol
Exact Mass214.99
IUPAC Name2-(2-bromophenoxy)ethanamine
SMILESNCCOc1ccccc1Br
InChIInChI=1S/C8H10BrNO/c9-7-3-1-2-4-8(7)11-6-5-10/h1-4H,5-6,10H2
InChIKeyUWRFNXLTMNVOTG-UHFFFAOYSA-N
XLogP1.79
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.08
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Phenoxyethanamine
CID 15651
1-Phenoxy-2-propanamine
CID 37087
5-((2-Bromophenoxy)methyl)-4,5-dihydro-1,3-oxazol-2-amine
CID 9816895
2-Bromophenetole
CID 68500
1-[2-(2-Bromophenoxy)ethyl]pyrrolidine
CID 867317
(3-Phenoxypropyl)amine
CID 418237
(4-Bromophenoxy)acetonitrile
CID 598823
2-(2-Bromophenoxy)-N,N-dimethylethanamine
CID 888311
2-(4-bromophenoxy)-N,N-diethylethanamine
CID 423953
4-(3-(2-Bromophenoxy)propyl)morpholine
CID 2057833
(2-(4-Bromophenoxy)ethyl)dimethylamine
CID 213877
1-Bromo-2-(2-bromoethoxy)benzene
CID 2734928

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenoxy)ethanamine?
The IUPAC name of 2-(2-bromophenoxy)ethanamine (CID 22688745) is 2-(2-bromophenoxy)ethanamine.
What is the SMILES notation for 2-(2-bromophenoxy)ethanamine?
The canonical SMILES for 2-(2-bromophenoxy)ethanamine is NCCOc1ccccc1Br.
What is the InChIKey of 2-(2-bromophenoxy)ethanamine?
The InChIKey is UWRFNXLTMNVOTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10BrNO/c9-7-3-1-2-4-8(7)11-6-5-10/h1-4H,5-6,10H2.
What are the key properties of 2-(2-bromophenoxy)ethanamine?
2-(2-bromophenoxy)ethanamine has a molecular weight of 216.08 g/mol, XLogP of 1.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenoxy)ethanamine is sourced from PubChem (CID 22688745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).