2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine

C11H14BrClN2O2 — CID 102635416

IUPAC2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine
SMILESCC1CNCC(COc2ncc(Cl)cc2Br)O1
InChIInChI=1S/C11H14BrClN2O2/c1-7-3-14-5-9(17-7)6-16-11-10(12)2-8(13)4-15-11/h2,4,7,9,14H,3,5-6H2,1H3
InChIKeyNZYKSGPZYXQVJF-UHFFFAOYSA-N
MW321.60 g/mol
LogP2.25
Rot. Bonds3

About 2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine

2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine (PubChem CID 102635416) has the molecular formula C11H14BrClN2O2 and a molecular weight of 321.60 g/mol. Its IUPAC name is 2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine.

Molecular Properties

Compound Name2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine
PubChem CID102635416
Molecular FormulaC11H14BrClN2O2
Molecular Weight321.60 g/mol
Exact Mass319.99
IUPAC Name2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine
SMILESCC1CNCC(COc2ncc(Cl)cc2Br)O1
InChIInChI=1S/C11H14BrClN2O2/c1-7-3-14-5-9(17-7)6-16-11-10(12)2-8(13)4-15-11/h2,4,7,9,14H,3,5-6H2,1H3
InChIKeyNZYKSGPZYXQVJF-UHFFFAOYSA-N
XLogP2.25
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.60
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine
CID 114838242
3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine
CID 114837569
3-bromo-5-chloro-2-(cyclopropylmethoxy)pyridine
CID 114837615
2-[(2-bromophenoxy)methyl]-6-methylmorpholine
CID 82307606
3-bromo-5-chloro-2-(cyclopentylmethoxy)pyridine
CID 114837797
(2R,6R)-2-methyl-6-(phenoxymethyl)morpholine
CID 95439704
3-bromo-5-chloro-2-(oxan-4-ylmethoxy)pyridine
CID 114837736
(6S)-2-[(2-bromo-4-chloro-6-fluorophenyl)methyl]-6-methylmorpholine
CID 170961562
5-iodo-4-[(6-methylmorpholin-2-yl)methoxy]-1H-pyrimidin-6-one
CID 102634996
2-[(6-methylmorpholin-2-yl)methoxy]-5-nitropyridine-3-carboxamide
CID 102634953
2-methyl-6-[(5-methyl-2-pyridinyl)oxymethyl]morpholine
CID 102635037
2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine
CID 114469123

Frequently Asked Questions

What is the IUPAC name of 2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine?
The IUPAC name of 2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine (CID 102635416) is 2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine.
What is the SMILES notation for 2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine?
The canonical SMILES for 2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine is CC1CNCC(COc2ncc(Cl)cc2Br)O1.
What is the InChIKey of 2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine?
The InChIKey is NZYKSGPZYXQVJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrClN2O2/c1-7-3-14-5-9(17-7)6-16-11-10(12)2-8(13)4-15-11/h2,4,7,9,14H,3,5-6H2,1H3.
What are the key properties of 2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine?
2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine has a molecular weight of 321.60 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine is sourced from PubChem (CID 102635416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).