2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol

C12H9N3O — CID 135434951

IUPAC2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol
SMILESOc1ccccc1-c1cc2nccnc2[nH]1
InChIInChI=1S/C12H9N3O/c16-11-4-2-1-3-8(11)9-7-10-12(15-9)14-6-5-13-10/h1-7,16H,(H,14,15)
InChIKeyNRAYXRKHXGQBQA-UHFFFAOYSA-N
MW211.22 g/mol
LogP2.33
Rot. Bonds1

About 2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol

2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol (PubChem CID 135434951) has the molecular formula C12H9N3O and a molecular weight of 211.22 g/mol. Its IUPAC name is 2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol.

Molecular Properties

Compound Name2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol
PubChem CID135434951
Molecular FormulaC12H9N3O
Molecular Weight211.22 g/mol
Exact Mass211.07
IUPAC Name2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol
SMILESOc1ccccc1-c1cc2nccnc2[nH]1
InChIInChI=1S/C12H9N3O/c16-11-4-2-1-3-8(11)9-7-10-12(15-9)14-6-5-13-10/h1-7,16H,(H,14,15)
InChIKeyNRAYXRKHXGQBQA-UHFFFAOYSA-N
XLogP2.33
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-thiophen-3-yl-5H-pyrrolo[2,3-b]pyrazine
CID 6538803
6-[1-(3-bromopropyl)indol-3-yl]-5H-pyrrolo[2,3-b]pyrazine
CID 22477410
2-[3-(2-hydroxyphenyl)-1H-pyrazol-5-yl]phenol
CID 136647220
3,5-dimethyl-4-[4-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenyl]-1,2-oxazole
CID 22477524
CID 68512721
CID 68512721
2-pyrimidin-2-ylphenol;zinc
CID 161346901
[2-methoxy-5-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenyl] acetate
CID 91137828
2-(1H-indol-2-yl)phenol;sulfuric acid
CID 155109187
2-[2-(1-aminocyclobutyl)-1H-imidazol-5-yl]phenol
CID 105486642
2-(2-trityl-1H-imidazol-5-yl)phenol
CID 67205769
2-pyridin-2-ylphenol;hydrate
CID 175244966
2-(2-hydroxyphenyl)-1H-indole-5-carboxylic acid
CID 54131699

Frequently Asked Questions

What is the IUPAC name of 2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol?
The IUPAC name of 2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol (CID 135434951) is 2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol.
What is the SMILES notation for 2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol?
The canonical SMILES for 2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol is Oc1ccccc1-c1cc2nccnc2[nH]1.
What is the InChIKey of 2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol?
The InChIKey is NRAYXRKHXGQBQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3O/c16-11-4-2-1-3-8(11)9-7-10-12(15-9)14-6-5-13-10/h1-7,16H,(H,14,15).
What are the key properties of 2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol?
2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol has a molecular weight of 211.22 g/mol, XLogP of 2.33, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5H-pyrrolo[2,3-b]pyrazin-6-yl)phenol is sourced from PubChem (CID 135434951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).