N-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide

C11H15BrN2O3S — CID 164633917

IUPACN-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide
SMILESCc1nc(NC(=O)COC[C@H]2CCCO2)sc1Br
InChIInChI=1S/C11H15BrN2O3S/c1-7-10(12)18-11(13-7)14-9(15)6-16-5-8-3-2-4-17-8/h8H,2-6H2,1H3,(H,13,14,15)/t8-/m1/s1
InChIKeyINUXRNQCWMXVPX-MRVPVSSYSA-N
MW335.22 g/mol
LogP2.35
Rot. Bonds5

About N-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide

N-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide (PubChem CID 164633917) has the molecular formula C11H15BrN2O3S and a molecular weight of 335.22 g/mol. Its IUPAC name is N-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide.

Molecular Properties

Compound NameN-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide
PubChem CID164633917
Molecular FormulaC11H15BrN2O3S
Molecular Weight335.22 g/mol
Exact Mass334.00
IUPAC NameN-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide
SMILESCc1nc(NC(=O)COC[C@H]2CCCO2)sc1Br
InChIInChI=1S/C11H15BrN2O3S/c1-7-10(12)18-11(13-7)14-9(15)6-16-5-8-3-2-4-17-8/h8H,2-6H2,1H3,(H,13,14,15)/t8-/m1/s1
InChIKeyINUXRNQCWMXVPX-MRVPVSSYSA-N
XLogP2.35
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.22
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]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 N-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide?
The IUPAC name of N-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide (CID 164633917) is N-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide.
What is the SMILES notation for N-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide?
The canonical SMILES for N-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide is Cc1nc(NC(=O)COC[C@H]2CCCO2)sc1Br.
What is the InChIKey of N-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide?
The InChIKey is INUXRNQCWMXVPX-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H15BrN2O3S/c1-7-10(12)18-11(13-7)14-9(15)6-16-5-8-3-2-4-17-8/h8H,2-6H2,1H3,(H,13,14,15)/t8-/m1/s1.
What are the key properties of N-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide?
N-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide has a molecular weight of 335.22 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2-[[(2R)-oxolan-2-yl]methoxy]acetamide is sourced from PubChem (CID 164633917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).