4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol

C16H11N3OS — CID 117164600

IUPAC4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol
SMILESOc1ccc(-n2c(-c3cccs3)nc3cccnc32)cc1
InChIInChI=1S/C16H11N3OS/c20-12-7-5-11(6-8-12)19-15-13(3-1-9-17-15)18-16(19)14-4-2-10-21-14/h1-10,20H
InChIKeyWRXLUJPPQXTQHF-UHFFFAOYSA-N
MW293.35 g/mol
LogP3.85
Rot. Bonds2

About 4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol

4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol (PubChem CID 117164600) has the molecular formula C16H11N3OS and a molecular weight of 293.35 g/mol. Its IUPAC name is 4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol.

Molecular Properties

Compound Name4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol
PubChem CID117164600
Molecular FormulaC16H11N3OS
Molecular Weight293.35 g/mol
Exact Mass293.06
IUPAC Name4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol
SMILESOc1ccc(-n2c(-c3cccs3)nc3cccnc32)cc1
InChIInChI=1S/C16H11N3OS/c20-12-7-5-11(6-8-12)19-15-13(3-1-9-17-15)18-16(19)14-4-2-10-21-14/h1-10,20H
InChIKeyWRXLUJPPQXTQHF-UHFFFAOYSA-N
XLogP3.85
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-pyridin-3-ylimidazo[4,5-b]pyridin-3-yl)phenol
CID 117164759
4-(4-hydroxyphenyl)-3-thiophen-2-yl-1H-1,2,4-triazole-5-thione
CID 142163527
3-phenyl-2-[2,4,5-tris(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine
CID 20606867
3-pyridin-2-yl-2-thiophen-2-ylquinazolin-4-one
CID 702514
4-[3-(4-aminophenyl)imidazo[4,5-b]pyridin-2-yl]-6-methylbenzene-1,3-diol
CID 178120438
3-(thiolan-2-ylmethyl)-2-thiophen-2-ylimidazo[4,5-b]pyridine
CID 117164349
3-[(3-fluorophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-b]pyridine
CID 117164454
3-(1-methylpyrrolidin-3-yl)-2-thiophen-2-ylimidazo[4,5-b]pyridine
CID 117164168
3-(4-ethylphenyl)-2-thiophen-2-ylimidazo[4,5-b]quinoxaline
CID 2015262
3-(4-methylphenyl)-2-[[3-(4-methylphenyl)imidazo[4,5-b]pyridin-2-yl]methoxymethyl]imidazo[4,5-b]pyridine
CID 20955885
3-naphthalen-2-yl-2-thiophen-2-ylquinazolin-4-one
CID 1116973
2-(2-fluorophenyl)-3-pyridin-4-ylimidazo[4,5-b]pyridine
CID 83430661

Frequently Asked Questions

What is the IUPAC name of 4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol?
The IUPAC name of 4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol (CID 117164600) is 4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol.
What is the SMILES notation for 4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol?
The canonical SMILES for 4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol is Oc1ccc(-n2c(-c3cccs3)nc3cccnc32)cc1.
What is the InChIKey of 4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol?
The InChIKey is WRXLUJPPQXTQHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N3OS/c20-12-7-5-11(6-8-12)19-15-13(3-1-9-17-15)18-16(19)14-4-2-10-21-14/h1-10,20H.
What are the key properties of 4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol?
4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol has a molecular weight of 293.35 g/mol, XLogP of 3.85, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-thiophen-2-ylimidazo[4,5-b]pyridin-3-yl)phenol is sourced from PubChem (CID 117164600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).