2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine

C8H8FN3 — CID 174768802

IUPAC2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine
SMILESFc1nccnc1N1C=CCC1
InChIInChI=1S/C8H8FN3/c9-7-8(11-4-3-10-7)12-5-1-2-6-12/h1,3-5H,2,6H2
InChIKeyHOVHVHHKZWBJPD-UHFFFAOYSA-N
MW165.17 g/mol
LogP1.34
Rot. Bonds1

About 2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine

2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine (PubChem CID 174768802) has the molecular formula C8H8FN3 and a molecular weight of 165.17 g/mol. Its IUPAC name is 2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine.

Molecular Properties

Compound Name2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine
PubChem CID174768802
Molecular FormulaC8H8FN3
Molecular Weight165.17 g/mol
Exact Mass165.07
IUPAC Name2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine
SMILESFc1nccnc1N1C=CCC1
InChIInChI=1S/C8H8FN3/c9-7-8(11-4-3-10-7)12-5-1-2-6-12/h1,3-5H,2,6H2
InChIKeyHOVHVHHKZWBJPD-UHFFFAOYSA-N
XLogP1.34
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.17
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine?
The IUPAC name of 2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine (CID 174768802) is 2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine.
What is the SMILES notation for 2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine?
The canonical SMILES for 2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine is Fc1nccnc1N1C=CCC1.
What is the InChIKey of 2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine?
The InChIKey is HOVHVHHKZWBJPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FN3/c9-7-8(11-4-3-10-7)12-5-1-2-6-12/h1,3-5H,2,6H2.
What are the key properties of 2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine?
2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine has a molecular weight of 165.17 g/mol, XLogP of 1.34, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydropyrrol-1-yl)-3-fluoropyrazine is sourced from PubChem (CID 174768802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).