3-(2-bromophenyl)morpholine;hydrochloride

C10H13BrClNO — CID 155487565

IUPAC3-(2-bromophenyl)morpholine;hydrochloride
SMILESBrc1ccccc1C1COCCN1.Cl
InChIInChI=1S/C10H12BrNO.ClH/c11-9-4-2-1-3-8(9)10-7-13-6-5-12-10;/h1-4,10,12H,5-7H2;1H
InChIKeySFHWUSCPLQPIJM-UHFFFAOYSA-N
MW278.58 g/mol
LogP2.53
Rot. Bonds1

About 3-(2-bromophenyl)morpholine;hydrochloride

3-(2-bromophenyl)morpholine;hydrochloride (PubChem CID 155487565) has the molecular formula C10H13BrClNO and a molecular weight of 278.58 g/mol. Its IUPAC name is 3-(2-bromophenyl)morpholine;hydrochloride.

Molecular Properties

Compound Name3-(2-bromophenyl)morpholine;hydrochloride
PubChem CID155487565
Molecular FormulaC10H13BrClNO
Molecular Weight278.58 g/mol
Exact Mass276.99
IUPAC Name3-(2-bromophenyl)morpholine;hydrochloride
SMILESBrc1ccccc1C1COCCN1.Cl
InChIInChI=1S/C10H12BrNO.ClH/c11-9-4-2-1-3-8(9)10-7-13-6-5-12-10;/h1-4,10,12H,5-7H2;1H
InChIKeySFHWUSCPLQPIJM-UHFFFAOYSA-N
XLogP2.53
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.58
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-bromophenyl)morpholine;hydrochloride?
The IUPAC name of 3-(2-bromophenyl)morpholine;hydrochloride (CID 155487565) is 3-(2-bromophenyl)morpholine;hydrochloride.
What is the SMILES notation for 3-(2-bromophenyl)morpholine;hydrochloride?
The canonical SMILES for 3-(2-bromophenyl)morpholine;hydrochloride is Brc1ccccc1C1COCCN1.Cl.
What is the InChIKey of 3-(2-bromophenyl)morpholine;hydrochloride?
The InChIKey is SFHWUSCPLQPIJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrNO.ClH/c11-9-4-2-1-3-8(9)10-7-13-6-5-12-10;/h1-4,10,12H,5-7H2;1H.
What are the key properties of 3-(2-bromophenyl)morpholine;hydrochloride?
3-(2-bromophenyl)morpholine;hydrochloride has a molecular weight of 278.58 g/mol, XLogP of 2.53, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-bromophenyl)morpholine;hydrochloride is sourced from PubChem (CID 155487565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).