5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide

C9H9N3O3S — CID 63578720

IUPAC5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide
SMILESNNC(=O)c1ccc(Cn2ccsc2=O)o1
InChIInChI=1S/C9H9N3O3S/c10-11-8(13)7-2-1-6(15-7)5-12-3-4-16-9(12)14/h1-4H,5,10H2,(H,11,13)
InChIKeyUTZXRMAUTQPQNJ-UHFFFAOYSA-N
MW239.26 g/mol
LogP0.15
Rot. Bonds3

About 5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide

5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide (PubChem CID 63578720) has the molecular formula C9H9N3O3S and a molecular weight of 239.26 g/mol. Its IUPAC name is 5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide.

Molecular Properties

Compound Name5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide
PubChem CID63578720
Molecular FormulaC9H9N3O3S
Molecular Weight239.26 g/mol
Exact Mass239.04
IUPAC Name5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide
SMILESNNC(=O)c1ccc(Cn2ccsc2=O)o1
InChIInChI=1S/C9H9N3O3S/c10-11-8(13)7-2-1-6(15-7)5-12-3-4-16-9(12)14/h1-4H,5,10H2,(H,11,13)
InChIKeyUTZXRMAUTQPQNJ-UHFFFAOYSA-N
XLogP0.15
TPSA90.26 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.26
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-[(2-oxo-3-propylimidazol-1-yl)methyl]furan-2-carbohydrazide
CID 80582724
5-[(4,5-dimethyl-2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide
CID 55213097
5-[(3-cyclopropyl-2-oxoimidazol-1-yl)methyl]furan-2-carbohydrazide
CID 80582956
2-[4-[(2-oxo-1,3-thiazol-3-yl)methyl]phenyl]propanehydrazide
CID 105352208
5-[(1,3-dioxoisoindol-2-yl)methyl]furan-2-carbohydrazide
CID 63572812
5-[(5-bromoindol-1-yl)methyl]furan-2-carbohydrazide
CID 63577405
5-[(3-methylindol-1-yl)methyl]furan-2-carbohydrazide
CID 63577239
5-[(3-bromo-5-nitro-2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide
CID 104506056
5-[(3-chloroindol-1-yl)methyl]furan-2-carbohydrazide
CID 63578349
5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide
CID 79468557
5-[(2-oxoazocan-1-yl)methyl]furan-2-carbohydrazide
CID 55214250
5-[(1-oxophthalazin-2-yl)methyl]furan-2-carbohydrazide
CID 63571683

Frequently Asked Questions

What is the IUPAC name of 5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide?
The IUPAC name of 5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide (CID 63578720) is 5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide.
What is the SMILES notation for 5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide?
The canonical SMILES for 5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide is NNC(=O)c1ccc(Cn2ccsc2=O)o1.
What is the InChIKey of 5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide?
The InChIKey is UTZXRMAUTQPQNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O3S/c10-11-8(13)7-2-1-6(15-7)5-12-3-4-16-9(12)14/h1-4H,5,10H2,(H,11,13).
What are the key properties of 5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide?
5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide has a molecular weight of 239.26 g/mol, XLogP of 0.15, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-oxo-1,3-thiazol-3-yl)methyl]furan-2-carbohydrazide is sourced from PubChem (CID 63578720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).