6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine

C10H15BrN4O — CID 116796451

IUPAC6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine
SMILESCC1CN(c2nc(N)cc(Br)n2)C(C)CO1
InChIInChI=1S/C10H15BrN4O/c1-6-5-16-7(2)4-15(6)10-13-8(11)3-9(12)14-10/h3,6-7H,4-5H2,1-2H3,(H2,12,13,14)
InChIKeyNYNZOHSVDORHPU-UHFFFAOYSA-N
MW287.16 g/mol
LogP1.43
Rot. Bonds1

About 6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine

6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine (PubChem CID 116796451) has the molecular formula C10H15BrN4O and a molecular weight of 287.16 g/mol. Its IUPAC name is 6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine
PubChem CID116796451
Molecular FormulaC10H15BrN4O
Molecular Weight287.16 g/mol
Exact Mass286.04
IUPAC Name6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine
SMILESCC1CN(c2nc(N)cc(Br)n2)C(C)CO1
InChIInChI=1S/C10H15BrN4O/c1-6-5-16-7(2)4-15(6)10-13-8(11)3-9(12)14-10/h3,6-7H,4-5H2,1-2H3,(H2,12,13,14)
InChIKeyNYNZOHSVDORHPU-UHFFFAOYSA-N
XLogP1.43
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
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 ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine?
The IUPAC name of 6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine (CID 116796451) is 6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine?
The canonical SMILES for 6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine is CC1CN(c2nc(N)cc(Br)n2)C(C)CO1.
What is the InChIKey of 6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine?
The InChIKey is NYNZOHSVDORHPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN4O/c1-6-5-16-7(2)4-15(6)10-13-8(11)3-9(12)14-10/h3,6-7H,4-5H2,1-2H3,(H2,12,13,14).
What are the key properties of 6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine?
6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine has a molecular weight of 287.16 g/mol, XLogP of 1.43, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(2,5-dimethylmorpholin-4-yl)pyrimidin-4-amine is sourced from PubChem (CID 116796451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).