2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide

C12H18N2O3S — CID 110374670

IUPAC2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide
SMILESCOCc1nc(CC(=O)NCC2CCCO2)cs1
InChIInChI=1S/C12H18N2O3S/c1-16-7-12-14-9(8-18-12)5-11(15)13-6-10-3-2-4-17-10/h8,10H,2-7H2,1H3,(H,13,15)
InChIKeyFOFMQEKPDUBIAF-UHFFFAOYSA-N
MW270.35 g/mol
LogP1.13
Rot. Bonds6

About 2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide

2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide (PubChem CID 110374670) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is 2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide
PubChem CID110374670
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC Name2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide
SMILESCOCc1nc(CC(=O)NCC2CCCO2)cs1
InChIInChI=1S/C12H18N2O3S/c1-16-7-12-14-9(8-18-12)5-11(15)13-6-10-3-2-4-17-10/h8,10H,2-7H2,1H3,(H,13,15)
InChIKeyFOFMQEKPDUBIAF-UHFFFAOYSA-N
XLogP1.13
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide?
The IUPAC name of 2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide (CID 110374670) is 2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide?
The canonical SMILES for 2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide is COCc1nc(CC(=O)NCC2CCCO2)cs1.
What is the InChIKey of 2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide?
The InChIKey is FOFMQEKPDUBIAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-16-7-12-14-9(8-18-12)5-11(15)13-6-10-3-2-4-17-10/h8,10H,2-7H2,1H3,(H,13,15).
What are the key properties of 2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide?
2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide has a molecular weight of 270.35 g/mol, XLogP of 1.13, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(oxolan-2-ylmethyl)acetamide is sourced from PubChem (CID 110374670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).