2-(2-chloro-4-pyridinyl)pyrazine

C9H6ClN3 — CID 71615032

IUPAC2-(2-chloro-4-pyridinyl)pyrazine
SMILESClc1cc(-c2cnccn2)ccn1
InChIInChI=1S/C9H6ClN3/c10-9-5-7(1-2-13-9)8-6-11-3-4-12-8/h1-6H
InChIKeyGVBUIDQNWOJCJA-UHFFFAOYSA-N
MW191.62 g/mol
LogP2.19
Rot. Bonds1

About 2-(2-chloro-4-pyridinyl)pyrazine

2-(2-chloro-4-pyridinyl)pyrazine (PubChem CID 71615032) has the molecular formula C9H6ClN3 and a molecular weight of 191.62 g/mol. Its IUPAC name is 2-(2-chloro-4-pyridinyl)pyrazine.

Molecular Properties

Compound Name2-(2-chloro-4-pyridinyl)pyrazine
PubChem CID71615032
Molecular FormulaC9H6ClN3
Molecular Weight191.62 g/mol
Exact Mass191.03
IUPAC Name2-(2-chloro-4-pyridinyl)pyrazine
SMILESClc1cc(-c2cnccn2)ccn1
InChIInChI=1S/C9H6ClN3/c10-9-5-7(1-2-13-9)8-6-11-3-4-12-8/h1-6H
InChIKeyGVBUIDQNWOJCJA-UHFFFAOYSA-N
XLogP2.19
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.62
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-(2-phenyl-4-pyridinyl)pyrazine
CID 58421040
4-(2-chloro-4-pyridinyl)-2-phenylpyrimidine
CID 16637811
2-chloro-4-(2,3,4,5,6-pentachlorophenyl)pyridine
CID 134619705
2-chloropyrazine;trihydrochloride
CID 175594254
2-[4-chloro-3-(methoxymethyl)phenyl]pyrazine
CID 170557814
6-pyrazin-2-ylisoquinolin-1-amine
CID 123236793
tris(2-pyrazin-2-ylpyrazine);ruthenium(1+)
CID 138986841
2-(3-methyl-5-pyridin-4-ylphenyl)pyrazine
CID 144553900
2-(2,3-dihydro-1H-inden-5-yl)pyrazine
CID 141313830
4-(2-chloro-4-pyridinyl)thiophen-2-amine
CID 59011212
2-(3,4,5-trimethylphenyl)pyrazine
CID 126550614
2-[3-methyl-4-[(2-methylpropan-2-yl)oxy]phenyl]pyrazine
CID 175184638

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-pyridinyl)pyrazine?
The IUPAC name of 2-(2-chloro-4-pyridinyl)pyrazine (CID 71615032) is 2-(2-chloro-4-pyridinyl)pyrazine.
What is the SMILES notation for 2-(2-chloro-4-pyridinyl)pyrazine?
The canonical SMILES for 2-(2-chloro-4-pyridinyl)pyrazine is Clc1cc(-c2cnccn2)ccn1.
What is the InChIKey of 2-(2-chloro-4-pyridinyl)pyrazine?
The InChIKey is GVBUIDQNWOJCJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6ClN3/c10-9-5-7(1-2-13-9)8-6-11-3-4-12-8/h1-6H.
What are the key properties of 2-(2-chloro-4-pyridinyl)pyrazine?
2-(2-chloro-4-pyridinyl)pyrazine has a molecular weight of 191.62 g/mol, XLogP of 2.19, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-pyridinyl)pyrazine is sourced from PubChem (CID 71615032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).