1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine

C13H8F2N2 — CID 125478530

IUPAC1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine
SMILESFc1cc(F)cc(-c2nccn3cccc23)c1
InChIInChI=1S/C13H8F2N2/c14-10-6-9(7-11(15)8-10)13-12-2-1-4-17(12)5-3-16-13/h1-8H
InChIKeyDYGUZXZDODIEBM-UHFFFAOYSA-N
MW230.22 g/mol
LogP3.28
Rot. Bonds1

About 1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine

1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine (PubChem CID 125478530) has the molecular formula C13H8F2N2 and a molecular weight of 230.22 g/mol. Its IUPAC name is 1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine.

Molecular Properties

Compound Name1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine
PubChem CID125478530
Molecular FormulaC13H8F2N2
Molecular Weight230.22 g/mol
Exact Mass230.07
IUPAC Name1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine
SMILESFc1cc(F)cc(-c2nccn3cccc23)c1
InChIInChI=1S/C13H8F2N2/c14-10-6-9(7-11(15)8-10)13-12-2-1-4-17(12)5-3-16-13/h1-8H
InChIKeyDYGUZXZDODIEBM-UHFFFAOYSA-N
XLogP3.28
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.22
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine
CID 113303129
[2-(3,5-difluorophenyl)-3-pyridinyl]methanamine
CID 110282116
1-(4-imidazo[1,5-a]pyridin-1-ylphenyl)imidazo[1,5-a]pyridine
CID 4702100
1-pyridin-4-ylimidazo[1,5-a]pyridine
CID 171925806
8-(4-fluorophenyl)imidazo[1,2-a]pyrazine
CID 151841576
7-(3-fluorophenyl)imidazo[1,2-a]pyrimidine
CID 67176188
1-[(E)-2-phenylethenyl]pyrrolo[1,2-a]pyrazine
CID 15662093
1-[4-(4,6-dimethylpyrimidin-5-yl)-2,5-difluorophenoxy]pyrrolo[1,2-a]pyrazine
CID 118488443
5-(3-fluoro-5-methylphenyl)-1,6-naphthyridine
CID 162637917
imidazo[1,2-a]pyridin-8-amine;hydrochloride
CID 118705200
2-(3,5-difluorophenyl)-6-fluoropyridine
CID 130334927
2-chloro-3-(3-fluoro-5-methylphenyl)pyrazine
CID 79691462

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine?
The IUPAC name of 1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine (CID 125478530) is 1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine.
What is the SMILES notation for 1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine?
The canonical SMILES for 1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine is Fc1cc(F)cc(-c2nccn3cccc23)c1.
What is the InChIKey of 1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine?
The InChIKey is DYGUZXZDODIEBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8F2N2/c14-10-6-9(7-11(15)8-10)13-12-2-1-4-17(12)5-3-16-13/h1-8H.
What are the key properties of 1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine?
1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine has a molecular weight of 230.22 g/mol, XLogP of 3.28, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-difluorophenyl)pyrrolo[1,2-a]pyrazine is sourced from PubChem (CID 125478530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).