4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine

C11H11BrN2OS — CID 62082556

IUPAC4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine
SMILESCOc1ccc(Br)cc1-c1nc(C)sc1N
InChIInChI=1S/C11H11BrN2OS/c1-6-14-10(11(13)16-6)8-5-7(12)3-4-9(8)15-2/h3-5H,13H2,1-2H3
InChIKeyFQDUOMDFIORQRZ-UHFFFAOYSA-N
MW299.19 g/mol
LogP3.47
Rot. Bonds2

About 4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine

4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine (PubChem CID 62082556) has the molecular formula C11H11BrN2OS and a molecular weight of 299.19 g/mol. Its IUPAC name is 4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine.

Molecular Properties

Compound Name4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine
PubChem CID62082556
Molecular FormulaC11H11BrN2OS
Molecular Weight299.19 g/mol
Exact Mass297.98
IUPAC Name4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine
SMILESCOc1ccc(Br)cc1-c1nc(C)sc1N
InChIInChI=1S/C11H11BrN2OS/c1-6-14-10(11(13)16-6)8-5-7(12)3-4-9(8)15-2/h3-5H,13H2,1-2H3
InChIKeyFQDUOMDFIORQRZ-UHFFFAOYSA-N
XLogP3.47
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.19
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazole-5-carbaldehyde
CID 82135444
4-(4-bromo-2-fluorophenyl)-2-methyl-1,3-thiazol-5-amine
CID 62082559
4-(4-methoxy-2,5-dimethylphenyl)-2-methyl-1,3-thiazol-5-amine
CID 82480345
6-bromo-2-(5-bromo-2-methoxyphenyl)imidazo[1,2-a]pyridin-3-amine
CID 63618959
3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine
CID 82134756
2-(5-bromo-2-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
CID 63617266
5-bromo-4-(5-bromo-2-methoxyphenyl)-6-chloropyrimidin-2-amine
CID 24946892
2-methyl-4-(2,4,5-trimethylphenyl)-1,3-thiazol-5-amine
CID 82475382
2-(5-bromo-2-methoxyphenyl)-5-methoxy-4-methyl-1,3-thiazole
CID 116887531
2-[4-(5-bromo-2-methoxyphenyl)-6-methylpyrimidin-2-yl]propan-2-amine
CID 116892562
[4-(5-bromo-2-methoxyphenyl)-2-methoxy-1,3-thiazol-5-yl]methanol
CID 131866787
[2-(5-bromo-2-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]hydrazine
CID 116887788

Frequently Asked Questions

What is the IUPAC name of 4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine?
The IUPAC name of 4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine (CID 62082556) is 4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine.
What is the SMILES notation for 4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine?
The canonical SMILES for 4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine is COc1ccc(Br)cc1-c1nc(C)sc1N.
What is the InChIKey of 4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine?
The InChIKey is FQDUOMDFIORQRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2OS/c1-6-14-10(11(13)16-6)8-5-7(12)3-4-9(8)15-2/h3-5H,13H2,1-2H3.
What are the key properties of 4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine?
4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine has a molecular weight of 299.19 g/mol, XLogP of 3.47, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine is sourced from PubChem (CID 62082556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).