N-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide

C7H9ClN2O2S — CID 130669871

IUPACN-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide
SMILESCC(C)(O)C(=O)Nc1ncc(Cl)s1
InChIInChI=1S/C7H9ClN2O2S/c1-7(2,12)5(11)10-6-9-3-4(8)13-6/h3,12H,1-2H3,(H,9,10,11)
InChIKeyBKPARICDYHOIMU-UHFFFAOYSA-N
MW220.68 g/mol
LogP1.51
Rot. Bonds2

About N-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide

N-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide (PubChem CID 130669871) has the molecular formula C7H9ClN2O2S and a molecular weight of 220.68 g/mol. Its IUPAC name is N-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide.

Molecular Properties

Compound NameN-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide
PubChem CID130669871
Molecular FormulaC7H9ClN2O2S
Molecular Weight220.68 g/mol
Exact Mass220.01
IUPAC NameN-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide
SMILESCC(C)(O)C(=O)Nc1ncc(Cl)s1
InChIInChI=1S/C7H9ClN2O2S/c1-7(2,12)5(11)10-6-9-3-4(8)13-6/h3,12H,1-2H3,(H,9,10,11)
InChIKeyBKPARICDYHOIMU-UHFFFAOYSA-N
XLogP1.51
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.68
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide?
The IUPAC name of N-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide (CID 130669871) is N-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide.
What is the SMILES notation for N-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide?
The canonical SMILES for N-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide is CC(C)(O)C(=O)Nc1ncc(Cl)s1.
What is the InChIKey of N-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide?
The InChIKey is BKPARICDYHOIMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClN2O2S/c1-7(2,12)5(11)10-6-9-3-4(8)13-6/h3,12H,1-2H3,(H,9,10,11).
What are the key properties of N-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide?
N-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide has a molecular weight of 220.68 g/mol, XLogP of 1.51, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide is sourced from PubChem (CID 130669871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).