1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine

C11H8N2OS — CID 11458586

IUPAC1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine
SMILESOn1c(-c2cccs2)cc2ccncc21
InChIInChI=1S/C11H8N2OS/c14-13-9(11-2-1-5-15-11)6-8-3-4-12-7-10(8)13/h1-7,14H
InChIKeyGCAZYUCKGVNLQJ-UHFFFAOYSA-N
MW216.27 g/mol
LogP3.00
Rot. Bonds1

About 1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine

1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine (PubChem CID 11458586) has the molecular formula C11H8N2OS and a molecular weight of 216.27 g/mol. Its IUPAC name is 1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine
PubChem CID11458586
Molecular FormulaC11H8N2OS
Molecular Weight216.27 g/mol
Exact Mass216.04
IUPAC Name1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine
SMILESOn1c(-c2cccs2)cc2ccncc21
InChIInChI=1S/C11H8N2OS/c14-13-9(11-2-1-5-15-11)6-8-3-4-12-7-10(8)13/h1-7,14H
InChIKeyGCAZYUCKGVNLQJ-UHFFFAOYSA-N
XLogP3.00
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.27
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

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Related Compounds

3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indole
CID 5329361
dimethyl(2-{3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indol-1-yl}ethyl)amine
CID 5329362
1-[2-(piperidin-1-yl)ethyl]-3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indole
CID 5329363
1-[3-(piperidin-1-yl)propyl]-3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indole
CID 5329365
1-[3-(4-methylpiperazin-1-yl)propyl]-3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indole
CID 5329366
dimethyl(3-{3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indol-1-yl}propyl)amine
CID 5329367
3-(5-Thien-3-ylpyridin-3-yl)-1Hindole 3h
CID 5329368
3-Methyl-1-(2-thiophen-3-ylethynyl)pyrrolo[1,2-a]pyrazine-7-carbonitrile
CID 44453143
Dimethyl-[2-(6-thiophen-3-yl-indol-1-yl)-ethyl]-amine
CID 18007589
1-thiophen-3-yl-9H-pyrido[3,4-b]indole
CID 44286020
US10377753, Example 130
CID 124175977
N,N-dimethyl-2-[6-(4-methylthiophen-2-yl)pyrrolo[3,2-b]pyridin-1-yl]acetamide
CID 124175991

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine?
The IUPAC name of 1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine (CID 11458586) is 1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine.
What is the SMILES notation for 1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine?
The canonical SMILES for 1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine is On1c(-c2cccs2)cc2ccncc21.
What is the InChIKey of 1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine?
The InChIKey is GCAZYUCKGVNLQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2OS/c14-13-9(11-2-1-5-15-11)6-8-3-4-12-7-10(8)13/h1-7,14H.
What are the key properties of 1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine?
1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine has a molecular weight of 216.27 g/mol, XLogP of 3.00, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-2-thiophen-2-ylpyrrolo[2,3-c]pyridine is sourced from PubChem (CID 11458586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).