2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine

C10H9BrN2OS — CID 107283345

IUPAC2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine
SMILESCc1ccc(Br)cc1Oc1ncc(N)s1
InChIInChI=1S/C10H9BrN2OS/c1-6-2-3-7(11)4-8(6)14-10-13-5-9(12)15-10/h2-5H,12H2,1H3
InChIKeyJDUULGCZTNVMKS-UHFFFAOYSA-N
MW285.17 g/mol
LogP3.59
Rot. Bonds2

About 2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine

2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine (PubChem CID 107283345) has the molecular formula C10H9BrN2OS and a molecular weight of 285.17 g/mol. Its IUPAC name is 2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine.

Molecular Properties

Compound Name2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine
PubChem CID107283345
Molecular FormulaC10H9BrN2OS
Molecular Weight285.17 g/mol
Exact Mass283.96
IUPAC Name2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine
SMILESCc1ccc(Br)cc1Oc1ncc(N)s1
InChIInChI=1S/C10H9BrN2OS/c1-6-2-3-7(11)4-8(6)14-10-13-5-9(12)15-10/h2-5H,12H2,1H3
InChIKeyJDUULGCZTNVMKS-UHFFFAOYSA-N
XLogP3.59
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.17
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-chloro-4-methylphenoxy)-1,3-thiazol-5-amine
CID 102769480
6-(5-bromo-2-methylphenoxy)pyridin-3-amine
CID 107283348
5-(5-bromo-2-methylphenoxy)-3-(trifluoromethyl)-1,2,4-thiadiazole
CID 107304603
5-(bromomethyl)-2-(5-bromo-2-methylphenoxy)-3-methylpyridine
CID 107284943
2-(5-bromo-2-methylphenoxy)pyrazine
CID 107284336
2-(5-bromo-2-methylphenoxy)-3,5-dichloropyridine
CID 107284494
[5-(5-bromo-2-methylphenoxy)pyrazin-2-yl]methanamine
CID 107283228
2-amino-5-(5-bromo-2-methylphenoxy)pyridine-4-carboxamide
CID 114195729
3-bromo-4-(5-bromo-2-methylphenoxy)aniline
CID 107283299
2-(5-bromo-2-methylphenoxy)-5-(trifluoromethyl)pyridine
CID 66876057
1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol
CID 107284929
1-[5-(5-bromo-2-methylphenoxy)-2-pyridinyl]ethanol
CID 107284882

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine?
The IUPAC name of 2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine (CID 107283345) is 2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine.
What is the SMILES notation for 2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine?
The canonical SMILES for 2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine is Cc1ccc(Br)cc1Oc1ncc(N)s1.
What is the InChIKey of 2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine?
The InChIKey is JDUULGCZTNVMKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrN2OS/c1-6-2-3-7(11)4-8(6)14-10-13-5-9(12)15-10/h2-5H,12H2,1H3.
What are the key properties of 2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine?
2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine has a molecular weight of 285.17 g/mol, XLogP of 3.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-methylphenoxy)-1,3-thiazol-5-amine is sourced from PubChem (CID 107283345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).