3-(6-bromonaphthalen-2-yl)morpholine

C14H14BrNO — CID 175413265

IUPAC3-(6-bromonaphthalen-2-yl)morpholine
SMILESBrc1ccc2cc(C3COCCN3)ccc2c1
InChIInChI=1S/C14H14BrNO/c15-13-4-3-10-7-12(2-1-11(10)8-13)14-9-17-6-5-16-14/h1-4,7-8,14,16H,5-6,9H2
InChIKeyZKTDFPILGOSZND-UHFFFAOYSA-N
MW292.18 g/mol
LogP3.26
Rot. Bonds1

About 3-(6-bromonaphthalen-2-yl)morpholine

3-(6-bromonaphthalen-2-yl)morpholine (PubChem CID 175413265) has the molecular formula C14H14BrNO and a molecular weight of 292.18 g/mol. Its IUPAC name is 3-(6-bromonaphthalen-2-yl)morpholine.

Molecular Properties

Compound Name3-(6-bromonaphthalen-2-yl)morpholine
PubChem CID175413265
Molecular FormulaC14H14BrNO
Molecular Weight292.18 g/mol
Exact Mass291.03
IUPAC Name3-(6-bromonaphthalen-2-yl)morpholine
SMILESBrc1ccc2cc(C3COCCN3)ccc2c1
InChIInChI=1S/C14H14BrNO/c15-13-4-3-10-7-12(2-1-11(10)8-13)14-9-17-6-5-16-14/h1-4,7-8,14,16H,5-6,9H2
InChIKeyZKTDFPILGOSZND-UHFFFAOYSA-N
XLogP3.26
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.18
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(6-methylnaphthalen-2-yl)morpholine
CID 116963155
3-(3-bromophenyl)morpholine;hydrochloride
CID 122156777
(3R)-3-(3,4-dibromophenyl)morpholine
CID 130641524
3-(3,5-dibromophenyl)morpholine
CID 126971173
(3S)-3-(3-bromo-4-chlorophenyl)morpholine
CID 130748628
(3R)-3-(5-bromo-2-methylphenyl)morpholine
CID 130632472
(3S)-3-(4-bromo-2-fluorophenyl)morpholine
CID 130618619
(3S)-3-(3,4-dimethylphenyl)morpholine;hydrochloride
CID 171193047
(3S)-3-(4-fluorophenyl)morpholine
CID 22860769
(3S)-3-(3-bromo-5-chlorophenyl)morpholine
CID 130626016
(3S)-3-(3-bromo-5-fluorophenyl)morpholine
CID 130605575
4-[(3R)-morpholin-3-yl]benzenethiol
CID 130654195

Frequently Asked Questions

What is the IUPAC name of 3-(6-bromonaphthalen-2-yl)morpholine?
The IUPAC name of 3-(6-bromonaphthalen-2-yl)morpholine (CID 175413265) is 3-(6-bromonaphthalen-2-yl)morpholine.
What is the SMILES notation for 3-(6-bromonaphthalen-2-yl)morpholine?
The canonical SMILES for 3-(6-bromonaphthalen-2-yl)morpholine is Brc1ccc2cc(C3COCCN3)ccc2c1.
What is the InChIKey of 3-(6-bromonaphthalen-2-yl)morpholine?
The InChIKey is ZKTDFPILGOSZND-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrNO/c15-13-4-3-10-7-12(2-1-11(10)8-13)14-9-17-6-5-16-14/h1-4,7-8,14,16H,5-6,9H2.
What are the key properties of 3-(6-bromonaphthalen-2-yl)morpholine?
3-(6-bromonaphthalen-2-yl)morpholine has a molecular weight of 292.18 g/mol, XLogP of 3.26, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-bromonaphthalen-2-yl)morpholine is sourced from PubChem (CID 175413265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).