4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide

C7H8N2O2S — CID 130890993

IUPAC4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide
SMILESO=C(NO)c1scnc1C1CC1
InChIInChI=1S/C7H8N2O2S/c10-7(9-11)6-5(4-1-2-4)8-3-12-6/h3-4,11H,1-2H2,(H,9,10)
InChIKeyAZUIQTHEFGSTOI-UHFFFAOYSA-N
MW184.22 g/mol
LogP1.14
Rot. Bonds2

About 4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide

4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide (PubChem CID 130890993) has the molecular formula C7H8N2O2S and a molecular weight of 184.22 g/mol. Its IUPAC name is 4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide
PubChem CID130890993
Molecular FormulaC7H8N2O2S
Molecular Weight184.22 g/mol
Exact Mass184.03
IUPAC Name4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide
SMILESO=C(NO)c1scnc1C1CC1
InChIInChI=1S/C7H8N2O2S/c10-7(9-11)6-5(4-1-2-4)8-3-12-6/h3-4,11H,1-2H2,(H,9,10)
InChIKeyAZUIQTHEFGSTOI-UHFFFAOYSA-N
XLogP1.14
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.22
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide (CID 130890993) is 4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide is O=C(NO)c1scnc1C1CC1.
What is the InChIKey of 4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide?
The InChIKey is AZUIQTHEFGSTOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2S/c10-7(9-11)6-5(4-1-2-4)8-3-12-6/h3-4,11H,1-2H2,(H,9,10).
What are the key properties of 4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide?
4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide has a molecular weight of 184.22 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-N-hydroxy-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 130890993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).