5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid

C10H7NO3S — CID 18801324

IUPAC5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid
SMILESO=C(O)c1ccc(-c2cncc(O)c2)s1
InChIInChI=1S/C10H7NO3S/c12-7-3-6(4-11-5-7)8-1-2-9(15-8)10(13)14/h1-5,12H,(H,13,14)
InChIKeyVHTBZEHTFBPECG-UHFFFAOYSA-N
MW221.24 g/mol
LogP2.21
Rot. Bonds2

About 5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid

5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid (PubChem CID 18801324) has the molecular formula C10H7NO3S and a molecular weight of 221.24 g/mol. Its IUPAC name is 5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid.

Molecular Properties

Compound Name5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid
PubChem CID18801324
Molecular FormulaC10H7NO3S
Molecular Weight221.24 g/mol
Exact Mass221.01
IUPAC Name5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid
SMILESO=C(O)c1ccc(-c2cncc(O)c2)s1
InChIInChI=1S/C10H7NO3S/c12-7-3-6(4-11-5-7)8-1-2-9(15-8)10(13)14/h1-5,12H,(H,13,14)
InChIKeyVHTBZEHTFBPECG-UHFFFAOYSA-N
XLogP2.21
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.24
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid?
The IUPAC name of 5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid (CID 18801324) is 5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid.
What is the SMILES notation for 5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid?
The canonical SMILES for 5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid is O=C(O)c1ccc(-c2cncc(O)c2)s1.
What is the InChIKey of 5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid?
The InChIKey is VHTBZEHTFBPECG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7NO3S/c12-7-3-6(4-11-5-7)8-1-2-9(15-8)10(13)14/h1-5,12H,(H,13,14).
What are the key properties of 5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid?
5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid has a molecular weight of 221.24 g/mol, XLogP of 2.21, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-hydroxy-3-pyridinyl)thiophene-2-carboxylic acid is sourced from PubChem (CID 18801324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).