[4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol

C11H15BrN2O2 — CID 81208358

IUPAC[4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol
SMILESCC1COC(CO)CN1c1cccc(Br)n1
InChIInChI=1S/C11H15BrN2O2/c1-8-7-16-9(6-15)5-14(8)11-4-2-3-10(12)13-11/h2-4,8-9,15H,5-7H2,1H3
InChIKeyHUEJRBIFPHXPPD-UHFFFAOYSA-N
MW287.16 g/mol
LogP1.43
Rot. Bonds2

About [4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol

[4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol (PubChem CID 81208358) has the molecular formula C11H15BrN2O2 and a molecular weight of 287.16 g/mol. Its IUPAC name is [4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol
PubChem CID81208358
Molecular FormulaC11H15BrN2O2
Molecular Weight287.16 g/mol
Exact Mass286.03
IUPAC Name[4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol
SMILESCC1COC(CO)CN1c1cccc(Br)n1
InChIInChI=1S/C11H15BrN2O2/c1-8-7-16-9(6-15)5-14(8)11-4-2-3-10(12)13-11/h2-4,8-9,15H,5-7H2,1H3
InChIKeyHUEJRBIFPHXPPD-UHFFFAOYSA-N
XLogP1.43
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.16
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

[4-(6-amino-2-pyridinyl)-5-methylmorpholin-2-yl]methanol
CID 81218480
6-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]pyridine-2-carbothioamide
CID 81203310
(5-methyl-4-quinolin-2-ylmorpholin-2-yl)methanol
CID 81218885
[4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol
CID 131963742
[4-[6-(hydroxymethyl)pyrazin-2-yl]-5-methylmorpholin-2-yl]methanol
CID 81219850
[4-(5-amino-2-pyridinyl)-5-methylmorpholin-2-yl]methanol
CID 81205999
[5-methyl-4-[2-(methylamino)pyrimidin-4-yl]morpholin-2-yl]methanol
CID 81218201
[5-methyl-4-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]morpholin-2-yl]methanol
CID 81217243
[4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol
CID 114053206
(5-methyl-4-quinazolin-2-ylmorpholin-2-yl)methanol
CID 114789622
[4-(2-amino-5-bromopyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol
CID 81216804
6-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]pyrazine-2-carboxylic acid
CID 81204140

Frequently Asked Questions

What is the IUPAC name of [4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol (CID 81208358) is [4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol is CC1COC(CO)CN1c1cccc(Br)n1.
What is the InChIKey of [4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol?
The InChIKey is HUEJRBIFPHXPPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O2/c1-8-7-16-9(6-15)5-14(8)11-4-2-3-10(12)13-11/h2-4,8-9,15H,5-7H2,1H3.
What are the key properties of [4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol?
[4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol has a molecular weight of 287.16 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 81208358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).