5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine

C10H7BrClN3O — CID 103347910

IUPAC5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine
SMILESCOc1cccc(-c2ncc(Br)c(Cl)n2)n1
InChIInChI=1S/C10H7BrClN3O/c1-16-8-4-2-3-7(14-8)10-13-5-6(11)9(12)15-10/h2-5H,1H3
InChIKeyAADGDRJBGGGUFP-UHFFFAOYSA-N
MW300.54 g/mol
LogP2.96
Rot. Bonds2

About 5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine

5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine (PubChem CID 103347910) has the molecular formula C10H7BrClN3O and a molecular weight of 300.54 g/mol. Its IUPAC name is 5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine.

Molecular Properties

Compound Name5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine
PubChem CID103347910
Molecular FormulaC10H7BrClN3O
Molecular Weight300.54 g/mol
Exact Mass298.95
IUPAC Name5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine
SMILESCOc1cccc(-c2ncc(Br)c(Cl)n2)n1
InChIInChI=1S/C10H7BrClN3O/c1-16-8-4-2-3-7(14-8)10-13-5-6(11)9(12)15-10/h2-5H,1H3
InChIKeyAADGDRJBGGGUFP-UHFFFAOYSA-N
XLogP2.96
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.54
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)-6-propylpyrimidine
CID 103347902
4-chloro-5-iodo-2-(6-methoxy-2-pyridinyl)-6-methylpyrimidine
CID 103347901
5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)-6-(2-methylpropyl)pyrimidine
CID 103347915
5-bromo-4-chloro-2-(1-methylpyrazol-3-yl)pyrimidine
CID 66291840
5-(5-bromo-4-chloropyrimidin-2-yl)-2-methoxy-1,3-thiazole
CID 130590473
2-(2-chlorophenyl)-6-methoxypyridine
CID 121009188
5-bromo-4-chloro-2-(1-methylimidazol-4-yl)pyrimidine
CID 130598652
5-bromo-4-chloro-2-(3-propan-2-yloxyphenyl)pyrimidine
CID 66314230
5-bromo-4-chloro-2-(4-ethoxyphenyl)pyrimidine
CID 66312090
4-chloro-5-iodo-2-(6-methoxypyridazin-3-yl)pyrimidine
CID 103373064
6-chloro-3-(6-methoxy-2-pyridinyl)imidazo[1,2-b]pyridazine
CID 139975761
2-(2,5-dichlorophenyl)-6-methoxypyridine
CID 118807970

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine?
The IUPAC name of 5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine (CID 103347910) is 5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine.
What is the SMILES notation for 5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine?
The canonical SMILES for 5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine is COc1cccc(-c2ncc(Br)c(Cl)n2)n1.
What is the InChIKey of 5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine?
The InChIKey is AADGDRJBGGGUFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrClN3O/c1-16-8-4-2-3-7(14-8)10-13-5-6(11)9(12)15-10/h2-5H,1H3.
What are the key properties of 5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine?
5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine has a molecular weight of 300.54 g/mol, XLogP of 2.96, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-chloro-2-(6-methoxy-2-pyridinyl)pyrimidine is sourced from PubChem (CID 103347910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).