2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide

C6H8N2O2S — CID 130927920

IUPAC2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide
SMILESO=C(CO)NCc1cncs1
InChIInChI=1S/C6H8N2O2S/c9-3-6(10)8-2-5-1-7-4-11-5/h1,4,9H,2-3H2,(H,8,10)
InChIKeyLYWRWZXSOQDCPF-UHFFFAOYSA-N
MW172.21 g/mol
LogP-0.25
Rot. Bonds3

About 2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide

2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide (PubChem CID 130927920) has the molecular formula C6H8N2O2S and a molecular weight of 172.21 g/mol. Its IUPAC name is 2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide.

Molecular Properties

Compound Name2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide
PubChem CID130927920
Molecular FormulaC6H8N2O2S
Molecular Weight172.21 g/mol
Exact Mass172.03
IUPAC Name2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide
SMILESO=C(CO)NCc1cncs1
InChIInChI=1S/C6H8N2O2S/c9-3-6(10)8-2-5-1-7-4-11-5/h1,4,9H,2-3H2,(H,8,10)
InChIKeyLYWRWZXSOQDCPF-UHFFFAOYSA-N
XLogP-0.25
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.21
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide?
The IUPAC name of 2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide (CID 130927920) is 2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide.
What is the SMILES notation for 2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide?
The canonical SMILES for 2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide is O=C(CO)NCc1cncs1.
What is the InChIKey of 2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide?
The InChIKey is LYWRWZXSOQDCPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O2S/c9-3-6(10)8-2-5-1-7-4-11-5/h1,4,9H,2-3H2,(H,8,10).
What are the key properties of 2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide?
2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide has a molecular weight of 172.21 g/mol, XLogP of -0.25, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(1,3-thiazol-5-ylmethyl)acetamide is sourced from PubChem (CID 130927920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).