2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane

C10H10BrClN2O — CID 159445754

IUPAC2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane
SMILESC.Cc1coc(-c2ncc(Br)cc2Cl)n1
InChIInChI=1S/C9H6BrClN2O.CH4/c1-5-4-14-9(13-5)8-7(11)2-6(10)3-12-8;/h2-4H,1H3;1H4
InChIKeyLSSWXDJJWIQWRA-UHFFFAOYSA-N
MW289.56 g/mol
LogP4.10
Rot. Bonds1

About 2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane

2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane (PubChem CID 159445754) has the molecular formula C10H10BrClN2O and a molecular weight of 289.56 g/mol. Its IUPAC name is 2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane.

Molecular Properties

Compound Name2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane
PubChem CID159445754
Molecular FormulaC10H10BrClN2O
Molecular Weight289.56 g/mol
Exact Mass287.97
IUPAC Name2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane
SMILESC.Cc1coc(-c2ncc(Br)cc2Cl)n1
InChIInChI=1S/C9H6BrClN2O.CH4/c1-5-4-14-9(13-5)8-7(11)2-6(10)3-12-8;/h2-4H,1H3;1H4
InChIKeyLSSWXDJJWIQWRA-UHFFFAOYSA-N
XLogP4.10
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.56
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-2-methyl-3-(4-methyl-1,3-oxazol-2-yl)aniline
CID 107874095
4-methyl-2-pyrimidin-2-yl-1,3-oxazole
CID 175957886
5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine
CID 106921576
2-(5-bromo-3-methyl-2-pyridinyl)-1,3,4-oxadiazole
CID 171373633
5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine
CID 103583097
5-bromo-3-chloro-2-(2-methylfuran-3-yl)sulfanylpyridine
CID 107781342
5-bromo-3-chloro-2-ethoxypyridine
CID 71303680
methyl 2-(5-bromo-3-chloro-2-pyridinyl)-7-chloropyrazolo[1,5-a]pyrimidine-5-carboxylate
CID 122663374
1-(5-bromo-3-chloro-2-pyridinyl)propan-1-one
CID 174823193
2-(5-bromo-3-chloro-2-pyridinyl)-1,3-thiazole-4-carboxamide
CID 91205174
5-bromo-3-chloro-2-(2-chloro-4-methylphenoxy)pyridine
CID 103583695
5-bromo-N-(4-bromo-2,6-dimethylphenyl)-3-chloropyridin-2-amine
CID 103583373

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane?
The IUPAC name of 2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane (CID 159445754) is 2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane.
What is the SMILES notation for 2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane?
The canonical SMILES for 2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane is C.Cc1coc(-c2ncc(Br)cc2Cl)n1.
What is the InChIKey of 2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane?
The InChIKey is LSSWXDJJWIQWRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6BrClN2O.CH4/c1-5-4-14-9(13-5)8-7(11)2-6(10)3-12-8;/h2-4H,1H3;1H4.
What are the key properties of 2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane?
2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane has a molecular weight of 289.56 g/mol, XLogP of 4.10, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-3-chloro-2-pyridinyl)-4-methyl-1,3-oxazole;methane is sourced from PubChem (CID 159445754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).