[4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol

C10H14BrN3O2 — CID 131963742

IUPAC[4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol
SMILESCC1COC(CO)CN1c1cc(Br)cnn1
InChIInChI=1S/C10H14BrN3O2/c1-7-6-16-9(5-15)4-14(7)10-2-8(11)3-12-13-10/h2-3,7,9,15H,4-6H2,1H3
InChIKeyDVHFKOZORPJLGY-UHFFFAOYSA-N
MW288.14 g/mol
LogP0.83
Rot. Bonds2

About [4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol

[4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol (PubChem CID 131963742) has the molecular formula C10H14BrN3O2 and a molecular weight of 288.14 g/mol. Its IUPAC name is [4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol
PubChem CID131963742
Molecular FormulaC10H14BrN3O2
Molecular Weight288.14 g/mol
Exact Mass287.03
IUPAC Name[4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol
SMILESCC1COC(CO)CN1c1cc(Br)cnn1
InChIInChI=1S/C10H14BrN3O2/c1-7-6-16-9(5-15)4-14(7)10-2-8(11)3-12-13-10/h2-3,7,9,15H,4-6H2,1H3
InChIKeyDVHFKOZORPJLGY-UHFFFAOYSA-N
XLogP0.83
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.14
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-(6-bromo-2-pyridinyl)-5-methylmorpholin-2-yl]methanol
CID 81208358
[4-(6-aminopyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol
CID 81218492
[4-[6-(hydroxymethyl)pyrazin-2-yl]-5-methylmorpholin-2-yl]methanol
CID 81219850
[4-(6-amino-2-pyridinyl)-5-methylmorpholin-2-yl]methanol
CID 81218480
[4-(5-amino-2-pyridinyl)-5-methylmorpholin-2-yl]methanol
CID 81205999
(5-methyl-4-quinolin-2-ylmorpholin-2-yl)methanol
CID 81218885
[4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol
CID 114053206
[4-(6-amino-2-cyclopropylpyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol
CID 81218063
[4-[2-amino-6-(methylamino)pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol
CID 81216913
5-bromo-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]benzenecarbothioamide
CID 114891967
[5-methyl-4-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]morpholin-2-yl]methanol
CID 81217243
[4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol
CID 102824323

Frequently Asked Questions

What is the IUPAC name of [4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol (CID 131963742) is [4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol is CC1COC(CO)CN1c1cc(Br)cnn1.
What is the InChIKey of [4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol?
The InChIKey is DVHFKOZORPJLGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrN3O2/c1-7-6-16-9(5-15)4-14(7)10-2-8(11)3-12-13-10/h2-3,7,9,15H,4-6H2,1H3.
What are the key properties of [4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol?
[4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol has a molecular weight of 288.14 g/mol, XLogP of 0.83, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(5-bromopyridazin-3-yl)-5-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 131963742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).