N-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide

C9H10N2O3S — CID 24687231

IUPACN-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide
SMILESCc1csc(NC(=O)C2=COCCO2)n1
InChIInChI=1S/C9H10N2O3S/c1-6-5-15-9(10-6)11-8(12)7-4-13-2-3-14-7/h4-5H,2-3H2,1H3,(H,10,11,12)
InChIKeyLTYVELYPCVWMGX-UHFFFAOYSA-N
MW226.26 g/mol
LogP1.28
Rot. Bonds2

About N-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide

N-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide (PubChem CID 24687231) has the molecular formula C9H10N2O3S and a molecular weight of 226.26 g/mol. Its IUPAC name is N-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide
PubChem CID24687231
Molecular FormulaC9H10N2O3S
Molecular Weight226.26 g/mol
Exact Mass226.04
IUPAC NameN-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide
SMILESCc1csc(NC(=O)C2=COCCO2)n1
InChIInChI=1S/C9H10N2O3S/c1-6-5-15-9(10-6)11-8(12)7-4-13-2-3-14-7/h4-5H,2-3H2,1H3,(H,10,11,12)
InChIKeyLTYVELYPCVWMGX-UHFFFAOYSA-N
XLogP1.28
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.26
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide 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

Ethyl 2-(5,6-dihydro-1,4-dioxine-2-carboxamido)thiazole-4-carboxylate
CID 4133003
N-(4-tert-butyl-1,3-thiazol-2-yl)-5,6-dihydro-1,4-dioxine-2-carboxamide
CID 4560518
5-methoxy-N-(4-methylthiazol-2-yl)-4-oxo-4H-pyran-2-carboxamide
CID 27378240
Ethyl 2-[(4-methyl-2-thiazolyl)amino]-2-oxoacetate
CID 2914163
N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 45802599
2-(2-methoxyethoxy)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide
CID 78863568
2-ethoxy-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 2163047
2-(2-methoxyethoxy)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 43037447
2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 60653914
N-(4-ethyl-1,3-thiazol-2-yl)-2-(2-methoxyethoxy)acetamide
CID 88564798
Ethyl 2-[2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-1,3-thiazol-4-yl]acetate
CID 4171860
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide
CID 18084530

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide?
The IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide (CID 24687231) is N-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide.
What is the SMILES notation for N-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide?
The canonical SMILES for N-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide is Cc1csc(NC(=O)C2=COCCO2)n1.
What is the InChIKey of N-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide?
The InChIKey is LTYVELYPCVWMGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O3S/c1-6-5-15-9(10-6)11-8(12)7-4-13-2-3-14-7/h4-5H,2-3H2,1H3,(H,10,11,12).
What are the key properties of N-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide?
N-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide has a molecular weight of 226.26 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide is sourced from PubChem (CID 24687231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).