2-phenyldiazenylthieno[2,3-b]pyridin-3-ol

C13H9N3OS — CID 137227991

IUPAC2-phenyldiazenylthieno[2,3-b]pyridin-3-ol
SMILESOc1c(/N=N/c2ccccc2)sc2ncccc12
InChIInChI=1S/C13H9N3OS/c17-11-10-7-4-8-14-12(10)18-13(11)16-15-9-5-2-1-3-6-9/h1-8,17H/b16-15+
InChIKeyVFTFJXMBNYIPNZ-FOCLMDBBSA-N
MW255.30 g/mol
LogP4.42
Rot. Bonds2

About 2-phenyldiazenylthieno[2,3-b]pyridin-3-ol

2-phenyldiazenylthieno[2,3-b]pyridin-3-ol (PubChem CID 137227991) has the molecular formula C13H9N3OS and a molecular weight of 255.30 g/mol. Its IUPAC name is 2-phenyldiazenylthieno[2,3-b]pyridin-3-ol.

Molecular Properties

Compound Name2-phenyldiazenylthieno[2,3-b]pyridin-3-ol
PubChem CID137227991
Molecular FormulaC13H9N3OS
Molecular Weight255.30 g/mol
Exact Mass255.05
IUPAC Name2-phenyldiazenylthieno[2,3-b]pyridin-3-ol
SMILESOc1c(/N=N/c2ccccc2)sc2ncccc12
InChIInChI=1S/C13H9N3OS/c17-11-10-7-4-8-14-12(10)18-13(11)16-15-9-5-2-1-3-6-9/h1-8,17H/b16-15+
InChIKeyVFTFJXMBNYIPNZ-FOCLMDBBSA-N
XLogP4.42
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.30
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'thiophene_hydroxy(28)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

2-[(4-methylphenyl)diazenyl]-1-benzothiophen-3-ol
CID 916163
phenyl 3-hydroxythieno[2,3-b]pyridine-2-carboxylate
CID 67872823
potassium;hydride;3-hydroxythieno[2,3-b]pyridine-2-carbonitrile
CID 173437283
2-[(4-phenyldiazenylphenyl)iminomethyl]pyridin-3-ol
CID 136776452
8-hydroxy-5-phenyldiazenylquinoline-7-carbaldehyde
CID 135404716
3-hydroxy-N-methylthieno[2,3-b]pyridine-2-carboxamide
CID 54710086
CID 135972894
CID 135972894
N-(2,2-diphenylethenyl)-3-hydroxythieno[2,3-b]pyridine-2-carboxamide
CID 54717219
phenyl(quinolin-7-yl)diazene
CID 555553
2-(3-hydroxythieno[2,3-b]pyridin-2-yl)-3-methylquinazolin-4-one
CID 135907111
5-[(4-sulfanylphenyl)diazenyl]quinolin-8-ol
CID 136791378
3-(pyridin-3-yldiazenyl)-1H-indol-2-ol
CID 136860029

Frequently Asked Questions

What is the IUPAC name of 2-phenyldiazenylthieno[2,3-b]pyridin-3-ol?
The IUPAC name of 2-phenyldiazenylthieno[2,3-b]pyridin-3-ol (CID 137227991) is 2-phenyldiazenylthieno[2,3-b]pyridin-3-ol.
What is the SMILES notation for 2-phenyldiazenylthieno[2,3-b]pyridin-3-ol?
The canonical SMILES for 2-phenyldiazenylthieno[2,3-b]pyridin-3-ol is Oc1c(/N=N/c2ccccc2)sc2ncccc12.
What is the InChIKey of 2-phenyldiazenylthieno[2,3-b]pyridin-3-ol?
The InChIKey is VFTFJXMBNYIPNZ-FOCLMDBBSA-N. The full InChI is InChI=1S/C13H9N3OS/c17-11-10-7-4-8-14-12(10)18-13(11)16-15-9-5-2-1-3-6-9/h1-8,17H/b16-15+.
What are the key properties of 2-phenyldiazenylthieno[2,3-b]pyridin-3-ol?
2-phenyldiazenylthieno[2,3-b]pyridin-3-ol has a molecular weight of 255.30 g/mol, XLogP of 4.42, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyldiazenylthieno[2,3-b]pyridin-3-ol is sourced from PubChem (CID 137227991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).