[2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine

C8H9N3OS — CID 82505420

IUPAC[2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine
SMILESCc1ncsc1-c1nc(CN)co1
InChIInChI=1S/C8H9N3OS/c1-5-7(13-4-10-5)8-11-6(2-9)3-12-8/h3-4H,2,9H2,1H3
InChIKeyVJIOHMBNDXGOBF-UHFFFAOYSA-N
MW195.25 g/mol
LogP1.57
Rot. Bonds2

About [2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine

[2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine (PubChem CID 82505420) has the molecular formula C8H9N3OS and a molecular weight of 195.25 g/mol. Its IUPAC name is [2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine.

Molecular Properties

Compound Name[2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine
PubChem CID82505420
Molecular FormulaC8H9N3OS
Molecular Weight195.25 g/mol
Exact Mass195.05
IUPAC Name[2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine
SMILESCc1ncsc1-c1nc(CN)co1
InChIInChI=1S/C8H9N3OS/c1-5-7(13-4-10-5)8-11-6(2-9)3-12-8/h3-4H,2,9H2,1H3
InChIKeyVJIOHMBNDXGOBF-UHFFFAOYSA-N
XLogP1.57
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.25
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-methyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-5-yl]methanamine
CID 130856930
[2-(3-chlorothiophen-2-yl)-1,3-oxazol-4-yl]methanamine
CID 80641432
2-[5-(4-methyl-1,3-thiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine
CID 61334499
[5-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine
CID 79139626
[2-(5-methylthiophen-3-yl)-1,3-oxazol-4-yl]methanamine
CID 131203856
2-[5-(4-methyl-1,3-thiazol-5-yl)-1,3,4-oxadiazol-2-yl]ethanamine
CID 62071809
2-[5-(4-methyl-1,3-thiazol-5-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine
CID 61325491
[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methanamine;hydrochloride
CID 131801125
3-bromo-5-(4-methyl-1,3-thiazol-5-yl)-1,2,4-oxadiazole
CID 112571697
[2-(3-methylfuran-2-yl)-1,3-oxazol-4-yl]methanamine
CID 65288641
[2-(5-bromo-4-methylthiophen-2-yl)-1,3-oxazol-4-yl]methanamine
CID 79997384
[2-(5-iodothiophen-3-yl)-1,3-oxazol-4-yl]methanamine
CID 79690654

Frequently Asked Questions

What is the IUPAC name of [2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine?
The IUPAC name of [2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine (CID 82505420) is [2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine.
What is the SMILES notation for [2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine?
The canonical SMILES for [2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine is Cc1ncsc1-c1nc(CN)co1.
What is the InChIKey of [2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine?
The InChIKey is VJIOHMBNDXGOBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3OS/c1-5-7(13-4-10-5)8-11-6(2-9)3-12-8/h3-4H,2,9H2,1H3.
What are the key properties of [2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine?
[2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine has a molecular weight of 195.25 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine is sourced from PubChem (CID 82505420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).