4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide

C15H13N3O2S — CID 134713201

IUPAC4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide
SMILESCc1ncsc1C(=O)Nc1onc(-c2ccccc2)c1C
InChIInChI=1S/C15H13N3O2S/c1-9-12(11-6-4-3-5-7-11)18-20-15(9)17-14(19)13-10(2)16-8-21-13/h3-8H,1-2H3,(H,17,19)
InChIKeyAXMUPWRHKXYUMI-UHFFFAOYSA-N
MW299.36 g/mol
LogP3.67
Rot. Bonds3

About 4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide

4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide (PubChem CID 134713201) has the molecular formula C15H13N3O2S and a molecular weight of 299.36 g/mol. Its IUPAC name is 4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide
PubChem CID134713201
Molecular FormulaC15H13N3O2S
Molecular Weight299.36 g/mol
Exact Mass299.07
IUPAC Name4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide
SMILESCc1ncsc1C(=O)Nc1onc(-c2ccccc2)c1C
InChIInChI=1S/C15H13N3O2S/c1-9-12(11-6-4-3-5-7-11)18-20-15(9)17-14(19)13-10(2)16-8-21-13/h3-8H,1-2H3,(H,17,19)
InChIKeyAXMUPWRHKXYUMI-UHFFFAOYSA-N
XLogP3.67
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.36
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide (CID 134713201) is 4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide is Cc1ncsc1C(=O)Nc1onc(-c2ccccc2)c1C.
What is the InChIKey of 4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide?
The InChIKey is AXMUPWRHKXYUMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2S/c1-9-12(11-6-4-3-5-7-11)18-20-15(9)17-14(19)13-10(2)16-8-21-13/h3-8H,1-2H3,(H,17,19).
What are the key properties of 4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide?
4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide has a molecular weight of 299.36 g/mol, XLogP of 3.67, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 134713201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).