N-(2-oxo-1,3-thiazol-3-yl)formamide

C4H4N2O2S — CID 174982585

IUPACN-(2-oxo-1,3-thiazol-3-yl)formamide
SMILESO=CNn1ccsc1=O
InChIInChI=1S/C4H4N2O2S/c7-3-5-6-1-2-9-4(6)8/h1-3H,(H,5,7)
InChIKeyAVRVSDYZMYQMPZ-UHFFFAOYSA-N
MW144.16 g/mol
LogP-0.39
Rot. Bonds2

About N-(2-oxo-1,3-thiazol-3-yl)formamide

N-(2-oxo-1,3-thiazol-3-yl)formamide (PubChem CID 174982585) has the molecular formula C4H4N2O2S and a molecular weight of 144.16 g/mol. Its IUPAC name is N-(2-oxo-1,3-thiazol-3-yl)formamide.

Molecular Properties

Compound NameN-(2-oxo-1,3-thiazol-3-yl)formamide
PubChem CID174982585
Molecular FormulaC4H4N2O2S
Molecular Weight144.16 g/mol
Exact Mass144.00
IUPAC NameN-(2-oxo-1,3-thiazol-3-yl)formamide
SMILESO=CNn1ccsc1=O
InChIInChI=1S/C4H4N2O2S/c7-3-5-6-1-2-9-4(6)8/h1-3H,(H,5,7)
InChIKeyAVRVSDYZMYQMPZ-UHFFFAOYSA-N
XLogP-0.39
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.16
LogP ≤ 5-0.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[(E)-but-2-enyl]-1,3-thiazol-2-one
CID 116622687
3-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-one
CID 116622641
2-(2-oxo-1,3-thiazol-3-yl)acetohydrazide
CID 63578715
N-(3-methyl-1,3-thiazol-2-ylidene)formamide
CID 142155624
3-(methoxymethyl)-1,3-thiazol-2-one
CID 115687879
2-(2-oxo-1,3-thiazol-3-yl)acetamide
CID 63312712
3-(3-chloropropyl)-1,3-thiazol-2-one
CID 63312790
N-(4-fluorophenyl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide
CID 113244392
N-methoxy-2-(2-oxo-1,3-thiazol-3-yl)acetamide
CID 130634246
ethyl 3-oxo-4-(2-oxo-1,3-thiazol-3-yl)butanoate
CID 63899098
3-[3-(cyclopropylamino)propyl]-1,3-thiazol-2-one
CID 63312459
N-(4-amino-2,6-dichlorophenyl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide
CID 55203691

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-1,3-thiazol-3-yl)formamide?
The IUPAC name of N-(2-oxo-1,3-thiazol-3-yl)formamide (CID 174982585) is N-(2-oxo-1,3-thiazol-3-yl)formamide.
What is the SMILES notation for N-(2-oxo-1,3-thiazol-3-yl)formamide?
The canonical SMILES for N-(2-oxo-1,3-thiazol-3-yl)formamide is O=CNn1ccsc1=O.
What is the InChIKey of N-(2-oxo-1,3-thiazol-3-yl)formamide?
The InChIKey is AVRVSDYZMYQMPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N2O2S/c7-3-5-6-1-2-9-4(6)8/h1-3H,(H,5,7).
What are the key properties of N-(2-oxo-1,3-thiazol-3-yl)formamide?
N-(2-oxo-1,3-thiazol-3-yl)formamide has a molecular weight of 144.16 g/mol, XLogP of -0.39, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-1,3-thiazol-3-yl)formamide is sourced from PubChem (CID 174982585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).