2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol

C10H15BrN4O2 — CID 24880693

IUPAC2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol
SMILESOCCNc1ncnc(N2CCOCC2)c1Br
InChIInChI=1S/C10H15BrN4O2/c11-8-9(12-1-4-16)13-7-14-10(8)15-2-5-17-6-3-15/h7,16H,1-6H2,(H,12,13,14)
InChIKeyUNZUFNANKWHDLJ-UHFFFAOYSA-N
MW303.16 g/mol
LogP0.48
Rot. Bonds4

About 2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol

2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol (PubChem CID 24880693) has the molecular formula C10H15BrN4O2 and a molecular weight of 303.16 g/mol. Its IUPAC name is 2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol
PubChem CID24880693
Molecular FormulaC10H15BrN4O2
Molecular Weight303.16 g/mol
Exact Mass302.04
IUPAC Name2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol
SMILESOCCNc1ncnc(N2CCOCC2)c1Br
InChIInChI=1S/C10H15BrN4O2/c11-8-9(12-1-4-16)13-7-14-10(8)15-2-5-17-6-3-15/h7,16H,1-6H2,(H,12,13,14)
InChIKeyUNZUFNANKWHDLJ-UHFFFAOYSA-N
XLogP0.48
TPSA70.51 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.16
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol?
The IUPAC name of 2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol (CID 24880693) is 2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol.
What is the SMILES notation for 2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol?
The canonical SMILES for 2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol is OCCNc1ncnc(N2CCOCC2)c1Br.
What is the InChIKey of 2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol?
The InChIKey is UNZUFNANKWHDLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN4O2/c11-8-9(12-1-4-16)13-7-14-10(8)15-2-5-17-6-3-15/h7,16H,1-6H2,(H,12,13,14).
What are the key properties of 2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol?
2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol has a molecular weight of 303.16 g/mol, XLogP of 0.48, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-bromo-6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol is sourced from PubChem (CID 24880693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).