N-hydroxy-1-benzothiophene-2-carboxamide

C9H7NO2S — CID 11708207

IUPACN-hydroxy-1-benzothiophene-2-carboxamide
SMILESO=C(NO)c1cc2ccccc2s1
InChIInChI=1S/C9H7NO2S/c11-9(10-12)8-5-6-3-1-2-4-7(6)13-8/h1-5,12H,(H,10,11)
InChIKeyUGJNLGFANIDLSB-UHFFFAOYSA-N
MW193.23 g/mol
LogP2.02
Rot. Bonds1

About N-hydroxy-1-benzothiophene-2-carboxamide

N-hydroxy-1-benzothiophene-2-carboxamide (PubChem CID 11708207) has the molecular formula C9H7NO2S and a molecular weight of 193.23 g/mol. Its IUPAC name is N-hydroxy-1-benzothiophene-2-carboxamide.

Molecular Properties

Compound NameN-hydroxy-1-benzothiophene-2-carboxamide
PubChem CID11708207
Molecular FormulaC9H7NO2S
Molecular Weight193.23 g/mol
Exact Mass193.02
IUPAC NameN-hydroxy-1-benzothiophene-2-carboxamide
SMILESO=C(NO)c1cc2ccccc2s1
InChIInChI=1S/C9H7NO2S/c11-9(10-12)8-5-6-3-1-2-4-7(6)13-8/h1-5,12H,(H,10,11)
InChIKeyUGJNLGFANIDLSB-UHFFFAOYSA-N
XLogP2.02
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.23
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 N-hydroxy-1-benzothiophene-2-carboxamide?
The IUPAC name of N-hydroxy-1-benzothiophene-2-carboxamide (CID 11708207) is N-hydroxy-1-benzothiophene-2-carboxamide.
What is the SMILES notation for N-hydroxy-1-benzothiophene-2-carboxamide?
The canonical SMILES for N-hydroxy-1-benzothiophene-2-carboxamide is O=C(NO)c1cc2ccccc2s1.
What is the InChIKey of N-hydroxy-1-benzothiophene-2-carboxamide?
The InChIKey is UGJNLGFANIDLSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7NO2S/c11-9(10-12)8-5-6-3-1-2-4-7(6)13-8/h1-5,12H,(H,10,11).
What are the key properties of N-hydroxy-1-benzothiophene-2-carboxamide?
N-hydroxy-1-benzothiophene-2-carboxamide has a molecular weight of 193.23 g/mol, XLogP of 2.02, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-1-benzothiophene-2-carboxamide is sourced from PubChem (CID 11708207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).