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

C9H11N3OS — CID 130856930

IUPAC[4-methyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-5-yl]methanamine
SMILESCc1nc(-c2scnc2C)oc1CN
InChIInChI=1S/C9H11N3OS/c1-5-7(3-10)13-9(12-5)8-6(2)11-4-14-8/h4H,3,10H2,1-2H3
InChIKeyXOWDYCVPANVQRK-UHFFFAOYSA-N
MW209.27 g/mol
LogP1.87
Rot. Bonds2

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

[4-methyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-5-yl]methanamine (PubChem CID 130856930) has the molecular formula C9H11N3OS and a molecular weight of 209.27 g/mol. Its IUPAC name is [4-methyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-5-yl]methanamine.

Molecular Properties

Compound Name[4-methyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-5-yl]methanamine
PubChem CID130856930
Molecular FormulaC9H11N3OS
Molecular Weight209.27 g/mol
Exact Mass209.06
IUPAC Name[4-methyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-5-yl]methanamine
SMILESCc1nc(-c2scnc2C)oc1CN
InChIInChI=1S/C9H11N3OS/c1-5-7(3-10)13-9(12-5)8-6(2)11-4-14-8/h4H,3,10H2,1-2H3
InChIKeyXOWDYCVPANVQRK-UHFFFAOYSA-N
XLogP1.87
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine
CID 82505420
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]ethanamine
CID 61334499
4-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazole-5-carboxylic acid
CID 104842317
[5-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-4-yl]methanamine
CID 79139626
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-(aminomethyl)-4-methyl-1,3-oxazol-5-yl]methanamine
CID 68802787
ethyl 4-cyclopropyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazole-5-carboxylate
CID 114372123
1-[5-(4-methyl-1,3-thiazol-5-yl)-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine
CID 61354307
1-[5-(4-methyl-1,3-thiazol-5-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol
CID 103096203

Frequently Asked Questions

What is the IUPAC name of [4-methyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-5-yl]methanamine?
The IUPAC name of [4-methyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-5-yl]methanamine (CID 130856930) is [4-methyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-5-yl]methanamine.
What is the SMILES notation for [4-methyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-5-yl]methanamine?
The canonical SMILES for [4-methyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-5-yl]methanamine is Cc1nc(-c2scnc2C)oc1CN.
What is the InChIKey of [4-methyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-5-yl]methanamine?
The InChIKey is XOWDYCVPANVQRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3OS/c1-5-7(3-10)13-9(12-5)8-6(2)11-4-14-8/h4H,3,10H2,1-2H3.
What are the key properties of [4-methyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-5-yl]methanamine?
[4-methyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-5-yl]methanamine has a molecular weight of 209.27 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-2-(4-methyl-1,3-thiazol-5-yl)-1,3-oxazol-5-yl]methanamine is sourced from PubChem (CID 130856930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).