2-hydroxybenzoic acid;thieno[3,2-c]pyridine

C14H11NO3S — CID 3049962

IUPAC2-hydroxybenzoic acid;thieno[3,2-c]pyridine
SMILESO=C(O)c1ccccc1O.c1cc2sccc2cn1
InChIInChI=1S/C7H5NS.C7H6O3/c1-3-8-5-6-2-4-9-7(1)6;8-6-4-2-1-3-5(6)7(9)10/h1-5H;1-4,8H,(H,9,10)
InChIKeyWQUIHIYURLIXQY-UHFFFAOYSA-N
MW273.31 g/mol
LogP3.39
Rot. Bonds1

About 2-hydroxybenzoic acid;thieno[3,2-c]pyridine

2-hydroxybenzoic acid;thieno[3,2-c]pyridine (PubChem CID 3049962) has the molecular formula C14H11NO3S and a molecular weight of 273.31 g/mol. Its IUPAC name is 2-hydroxybenzoic acid;thieno[3,2-c]pyridine.

Molecular Properties

Compound Name2-hydroxybenzoic acid;thieno[3,2-c]pyridine
PubChem CID3049962
Molecular FormulaC14H11NO3S
Molecular Weight273.31 g/mol
Exact Mass273.05
IUPAC Name2-hydroxybenzoic acid;thieno[3,2-c]pyridine
SMILESO=C(O)c1ccccc1O.c1cc2sccc2cn1
InChIInChI=1S/C7H5NS.C7H6O3/c1-3-8-5-6-2-4-9-7(1)6;8-6-4-2-1-3-5(6)7(9)10/h1-5H;1-4,8H,(H,9,10)
InChIKeyWQUIHIYURLIXQY-UHFFFAOYSA-N
XLogP3.39
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxybenzoic acid;thieno[3,2-c]pyridine?
The IUPAC name of 2-hydroxybenzoic acid;thieno[3,2-c]pyridine (CID 3049962) is 2-hydroxybenzoic acid;thieno[3,2-c]pyridine.
What is the SMILES notation for 2-hydroxybenzoic acid;thieno[3,2-c]pyridine?
The canonical SMILES for 2-hydroxybenzoic acid;thieno[3,2-c]pyridine is O=C(O)c1ccccc1O.c1cc2sccc2cn1.
What is the InChIKey of 2-hydroxybenzoic acid;thieno[3,2-c]pyridine?
The InChIKey is WQUIHIYURLIXQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5NS.C7H6O3/c1-3-8-5-6-2-4-9-7(1)6;8-6-4-2-1-3-5(6)7(9)10/h1-5H;1-4,8H,(H,9,10).
What are the key properties of 2-hydroxybenzoic acid;thieno[3,2-c]pyridine?
2-hydroxybenzoic acid;thieno[3,2-c]pyridine has a molecular weight of 273.31 g/mol, XLogP of 3.39, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxybenzoic acid;thieno[3,2-c]pyridine is sourced from PubChem (CID 3049962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).