2-(6-bromohexyl)morpholine

C10H20BrNO — CID 175195484

IUPAC2-(6-bromohexyl)morpholine
SMILESBrCCCCCCC1CNCCO1
InChIInChI=1S/C10H20BrNO/c11-6-4-2-1-3-5-10-9-12-7-8-13-10/h10,12H,1-9H2
InChIKeyDJPLUWYIDQKKAR-UHFFFAOYSA-N
MW250.18 g/mol
LogP2.32
Rot. Bonds6

About 2-(6-bromohexyl)morpholine

2-(6-bromohexyl)morpholine (PubChem CID 175195484) has the molecular formula C10H20BrNO and a molecular weight of 250.18 g/mol. Its IUPAC name is 2-(6-bromohexyl)morpholine.

Molecular Properties

Compound Name2-(6-bromohexyl)morpholine
PubChem CID175195484
Molecular FormulaC10H20BrNO
Molecular Weight250.18 g/mol
Exact Mass249.07
IUPAC Name2-(6-bromohexyl)morpholine
SMILESBrCCCCCCC1CNCCO1
InChIInChI=1S/C10H20BrNO/c11-6-4-2-1-3-5-10-9-12-7-8-13-10/h10,12H,1-9H2
InChIKeyDJPLUWYIDQKKAR-UHFFFAOYSA-N
XLogP2.32
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.18
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

2-heptylmorpholine
CID 65122133
(2R)-2-dodecylmorpholine
CID 129384651
2-hexadecylmorpholine;hydrobromide
CID 174842760
4-morpholin-2-ylbutan-1-ol
CID 66968859
azane;2-decylmorpholine;hydroiodide
CID 174921054
2-(12-bromododecyl)isoindole-1,3-dione;2-(12-morpholin-2-yldodecyl)isoindole-1,3-dione
CID 67622931
3-[(2R)-morpholin-2-yl]propan-1-amine
CID 92954644
chloro-dimethyl-(3-morpholin-2-ylpropyl)silane
CID 174707575
2-morpholin-2-ylethanol;hydrofluoride
CID 69116594
2-(morpholin-2-ylmethyl)morpholine
CID 18506039
ethane;3-morpholin-2-ylpropanal
CID 142839724
N-methyl-2-morpholin-2-ylethanamine
CID 14652595

Frequently Asked Questions

What is the IUPAC name of 2-(6-bromohexyl)morpholine?
The IUPAC name of 2-(6-bromohexyl)morpholine (CID 175195484) is 2-(6-bromohexyl)morpholine.
What is the SMILES notation for 2-(6-bromohexyl)morpholine?
The canonical SMILES for 2-(6-bromohexyl)morpholine is BrCCCCCCC1CNCCO1.
What is the InChIKey of 2-(6-bromohexyl)morpholine?
The InChIKey is DJPLUWYIDQKKAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20BrNO/c11-6-4-2-1-3-5-10-9-12-7-8-13-10/h10,12H,1-9H2.
What are the key properties of 2-(6-bromohexyl)morpholine?
2-(6-bromohexyl)morpholine has a molecular weight of 250.18 g/mol, XLogP of 2.32, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-bromohexyl)morpholine is sourced from PubChem (CID 175195484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).