2-(1H-pyrrol-3-yl)pyrazine

C8H7N3 — CID 12027212

IUPAC2-(1H-pyrrol-3-yl)pyrazine
SMILESc1cnc(-c2cc[nH]c2)cn1
InChIInChI=1S/C8H7N3/c1-2-9-5-7(1)8-6-10-3-4-11-8/h1-6,9H
InChIKeySMWUEJBIRQOVBU-UHFFFAOYSA-N
MW145.16 g/mol
LogP1.47
Rot. Bonds1

About 2-(1H-pyrrol-3-yl)pyrazine

2-(1H-pyrrol-3-yl)pyrazine (PubChem CID 12027212) has the molecular formula C8H7N3 and a molecular weight of 145.16 g/mol. Its IUPAC name is 2-(1H-pyrrol-3-yl)pyrazine.

Molecular Properties

Compound Name2-(1H-pyrrol-3-yl)pyrazine
PubChem CID12027212
Molecular FormulaC8H7N3
Molecular Weight145.16 g/mol
Exact Mass145.06
IUPAC Name2-(1H-pyrrol-3-yl)pyrazine
SMILESc1cnc(-c2cc[nH]c2)cn1
InChIInChI=1S/C8H7N3/c1-2-9-5-7(1)8-6-10-3-4-11-8/h1-6,9H
InChIKeySMWUEJBIRQOVBU-UHFFFAOYSA-N
XLogP1.47
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-pyrrol-3-yl)pyrazine?
The IUPAC name of 2-(1H-pyrrol-3-yl)pyrazine (CID 12027212) is 2-(1H-pyrrol-3-yl)pyrazine.
What is the SMILES notation for 2-(1H-pyrrol-3-yl)pyrazine?
The canonical SMILES for 2-(1H-pyrrol-3-yl)pyrazine is c1cnc(-c2cc[nH]c2)cn1.
What is the InChIKey of 2-(1H-pyrrol-3-yl)pyrazine?
The InChIKey is SMWUEJBIRQOVBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3/c1-2-9-5-7(1)8-6-10-3-4-11-8/h1-6,9H.
What are the key properties of 2-(1H-pyrrol-3-yl)pyrazine?
2-(1H-pyrrol-3-yl)pyrazine has a molecular weight of 145.16 g/mol, XLogP of 1.47, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-pyrrol-3-yl)pyrazine is sourced from PubChem (CID 12027212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).