2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide

C5H7N3O2S — CID 137320894

IUPAC2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide
SMILES[H]/N=C1\NC(=O)SC1CC(N)=O
InChIInChI=1S/C5H7N3O2S/c6-3(9)1-2-4(7)8-5(10)11-2/h2H,1H2,(H2,6,9)(H2,7,8,10)
InChIKeyLUZDKUSVQYYXAL-UHFFFAOYSA-N
MW173.20 g/mol
LogP-0.34
Rot. Bonds2

About 2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide

2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide (PubChem CID 137320894) has the molecular formula C5H7N3O2S and a molecular weight of 173.20 g/mol. Its IUPAC name is 2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide.

Molecular Properties

Compound Name2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide
PubChem CID137320894
Molecular FormulaC5H7N3O2S
Molecular Weight173.20 g/mol
Exact Mass173.03
IUPAC Name2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide
SMILES[H]/N=C1\NC(=O)SC1CC(N)=O
InChIInChI=1S/C5H7N3O2S/c6-3(9)1-2-4(7)8-5(10)11-2/h2H,1H2,(H2,6,9)(H2,7,8,10)
InChIKeyLUZDKUSVQYYXAL-UHFFFAOYSA-N
XLogP-0.34
TPSA96.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.20
LogP ≤ 5-0.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'thioester', 'substructure': 'N/A'}

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Related Compounds

2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetamide
CID 693708
(5S)-5-phenacyl-1,3-thiazolidine-2,4-dione
CID 7013183
2-[(5R)-2,4-dioxo-1,3-thiazolidin-5-yl]-N-[4-[[2-[(5R)-2,4-dioxo-1,3-thiazolidin-5-yl]acetyl]amino]phenyl]acetamide
CID 2135569
2-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yl)acetamide
CID 130019502
ethyl 2-(5-imino-3-methyl-2-oxoimidazolidin-4-yl)acetate
CID 138389169
2-imino-5-phenacyl-1,3-thiazolidin-4-one
CID 138978177
ethyl 2-(3-ethyl-5-imino-2-oxoimidazolidin-4-yl)acetate
CID 138389539
2-methoxyethyl 3-(2,4-dioxo-1,3-thiazolidin-5-yl)propanoate
CID 139831688
2-imino-5-[2-(4-methylphenyl)-2-oxoethyl]-1,3-thiazolidin-4-one
CID 146674629
5-(2,4-dioxo-1,3-thiazolidin-5-yl)-1,3-thiazolidine-2,4-dione
CID 3789493
N-ethyl-2-(5-imino-3-methyl-2-oxoimidazolidin-4-yl)acetamide
CID 138388887
2-(3-amino-4-oxoazetidin-2-yl)acetamide
CID 67366514

Frequently Asked Questions

What is the IUPAC name of 2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide?
The IUPAC name of 2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide (CID 137320894) is 2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide.
What is the SMILES notation for 2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide?
The canonical SMILES for 2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide is [H]/N=C1\NC(=O)SC1CC(N)=O.
What is the InChIKey of 2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide?
The InChIKey is LUZDKUSVQYYXAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O2S/c6-3(9)1-2-4(7)8-5(10)11-2/h2H,1H2,(H2,6,9)(H2,7,8,10).
What are the key properties of 2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide?
2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide has a molecular weight of 173.20 g/mol, XLogP of -0.34, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide is sourced from PubChem (CID 137320894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).