N-hydroxy-5-phenylthiophene-2-carboxamide

C11H9NO2S — CID 25002768

IUPACN-hydroxy-5-phenylthiophene-2-carboxamide
SMILESO=C(NO)c1ccc(-c2ccccc2)s1
InChIInChI=1S/C11H9NO2S/c13-11(12-14)10-7-6-9(15-10)8-4-2-1-3-5-8/h1-7,14H,(H,12,13)
InChIKeyXIQUFDAAPVAKOR-UHFFFAOYSA-N
MW219.27 g/mol
LogP2.53
Rot. Bonds2

About N-hydroxy-5-phenylthiophene-2-carboxamide

N-hydroxy-5-phenylthiophene-2-carboxamide (PubChem CID 25002768) has the molecular formula C11H9NO2S and a molecular weight of 219.27 g/mol. Its IUPAC name is N-hydroxy-5-phenylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-hydroxy-5-phenylthiophene-2-carboxamide
PubChem CID25002768
Molecular FormulaC11H9NO2S
Molecular Weight219.27 g/mol
Exact Mass219.04
IUPAC NameN-hydroxy-5-phenylthiophene-2-carboxamide
SMILESO=C(NO)c1ccc(-c2ccccc2)s1
InChIInChI=1S/C11H9NO2S/c13-11(12-14)10-7-6-9(15-10)8-4-2-1-3-5-8/h1-7,14H,(H,12,13)
InChIKeyXIQUFDAAPVAKOR-UHFFFAOYSA-N
XLogP2.53
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.27
LogP ≤ 52.53
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-5-phenylthiophene-2-carboxamide?
The IUPAC name of N-hydroxy-5-phenylthiophene-2-carboxamide (CID 25002768) is N-hydroxy-5-phenylthiophene-2-carboxamide.
What is the SMILES notation for N-hydroxy-5-phenylthiophene-2-carboxamide?
The canonical SMILES for N-hydroxy-5-phenylthiophene-2-carboxamide is O=C(NO)c1ccc(-c2ccccc2)s1.
What is the InChIKey of N-hydroxy-5-phenylthiophene-2-carboxamide?
The InChIKey is XIQUFDAAPVAKOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NO2S/c13-11(12-14)10-7-6-9(15-10)8-4-2-1-3-5-8/h1-7,14H,(H,12,13).
What are the key properties of N-hydroxy-5-phenylthiophene-2-carboxamide?
N-hydroxy-5-phenylthiophene-2-carboxamide has a molecular weight of 219.27 g/mol, XLogP of 2.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-5-phenylthiophene-2-carboxamide is sourced from PubChem (CID 25002768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).