N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide

C11H13N3O2S — CID 110686462

IUPACN-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide
SMILESCc1nc(CC(=O)Nc2nc(C)c(C)s2)co1
InChIInChI=1S/C11H13N3O2S/c1-6-7(2)17-11(12-6)14-10(15)4-9-5-16-8(3)13-9/h5H,4H2,1-3H3,(H,12,14,15)
InChIKeyVSUIZMZCSQSIGW-UHFFFAOYSA-N
MW251.31 g/mol
LogP2.24
Rot. Bonds3

About N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide

N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide (PubChem CID 110686462) has the molecular formula C11H13N3O2S and a molecular weight of 251.31 g/mol. Its IUPAC name is N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide
PubChem CID110686462
Molecular FormulaC11H13N3O2S
Molecular Weight251.31 g/mol
Exact Mass251.07
IUPAC NameN-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide
SMILESCc1nc(CC(=O)Nc2nc(C)c(C)s2)co1
InChIInChI=1S/C11H13N3O2S/c1-6-7(2)17-11(12-6)14-10(15)4-9-5-16-8(3)13-9/h5H,4H2,1-3H3,(H,12,14,15)
InChIKeyVSUIZMZCSQSIGW-UHFFFAOYSA-N
XLogP2.24
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.31
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide?
The IUPAC name of N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide (CID 110686462) is N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide.
What is the SMILES notation for N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide?
The canonical SMILES for N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide is Cc1nc(CC(=O)Nc2nc(C)c(C)s2)co1.
What is the InChIKey of N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide?
The InChIKey is VSUIZMZCSQSIGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2S/c1-6-7(2)17-11(12-6)14-10(15)4-9-5-16-8(3)13-9/h5H,4H2,1-3H3,(H,12,14,15).
What are the key properties of N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide?
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide has a molecular weight of 251.31 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methyl-1,3-oxazol-4-yl)acetamide is sourced from PubChem (CID 110686462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).