5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine

C10H15BrN2O2 — CID 106999386

IUPAC5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine
SMILESCCCC(C)Oc1ncc(Br)c(OC)n1
InChIInChI=1S/C10H15BrN2O2/c1-4-5-7(2)15-10-12-6-8(11)9(13-10)14-3/h6-7H,4-5H2,1-3H3
InChIKeyUDMDFACAPOWXGK-UHFFFAOYSA-N
MW275.15 g/mol
LogP2.82
Rot. Bonds5

About 5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine

5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine (PubChem CID 106999386) has the molecular formula C10H15BrN2O2 and a molecular weight of 275.15 g/mol. Its IUPAC name is 5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine.

Molecular Properties

Compound Name5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine
PubChem CID106999386
Molecular FormulaC10H15BrN2O2
Molecular Weight275.15 g/mol
Exact Mass274.03
IUPAC Name5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine
SMILESCCCC(C)Oc1ncc(Br)c(OC)n1
InChIInChI=1S/C10H15BrN2O2/c1-4-5-7(2)15-10-12-6-8(11)9(13-10)14-3/h6-7H,4-5H2,1-3H3
InChIKeyUDMDFACAPOWXGK-UHFFFAOYSA-N
XLogP2.82
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.15
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-4-methoxy-2-(2-methylpentoxy)pyrimidine
CID 106999391
5-bromo-2-(2-butoxyethoxy)-4-methoxypyrimidine
CID 106999157
1-N-(5-bromo-4-methoxypyrimidin-2-yl)pentane-1,2-diamine
CID 106999965
5-bromo-4-methyl-2-propan-2-yloxypyrimidine
CID 115038055
5-bromo-N-(2-ethoxypropyl)-4-methoxypyrimidin-2-amine
CID 103746057
5-bromo-2-(1-ethylpyrazol-4-yl)oxy-4-methoxypyrimidine
CID 106999377
5-bromo-4-methoxy-N-methyl-N-(4-methylpentan-2-yl)pyrimidin-2-amine
CID 103745897
5-bromo-4-methoxy-2-(2-methylpropylsulfanyl)pyrimidine
CID 106999437
2-pentan-2-yloxypyrimidine-4-carboxylic acid
CID 107555052
5-bromo-4-methoxy-N-(1-thiophen-2-ylbutyl)pyrimidin-2-amine
CID 106997660
5-bromo-2-methoxy-4-methylpyrimidine
CID 51401365
5-bromo-2-(2,4-dibromophenoxy)-4-methoxypyrimidine
CID 106999331

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine?
The IUPAC name of 5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine (CID 106999386) is 5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine.
What is the SMILES notation for 5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine?
The canonical SMILES for 5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine is CCCC(C)Oc1ncc(Br)c(OC)n1.
What is the InChIKey of 5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine?
The InChIKey is UDMDFACAPOWXGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN2O2/c1-4-5-7(2)15-10-12-6-8(11)9(13-10)14-3/h6-7H,4-5H2,1-3H3.
What are the key properties of 5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine?
5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine has a molecular weight of 275.15 g/mol, XLogP of 2.82, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-methoxy-2-pentan-2-yloxypyrimidine is sourced from PubChem (CID 106999386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).