6-chloro-5,6-dihydropyrido[2,3-b]pyrazine

C7H6ClN3 — CID 138740060

IUPAC6-chloro-5,6-dihydropyrido[2,3-b]pyrazine
SMILESClC1C=Cc2nccnc2N1
InChIInChI=1S/C7H6ClN3/c8-6-2-1-5-7(11-6)10-4-3-9-5/h1-4,6H,(H,10,11)
InChIKeyQWGOUEZVWBZEBV-UHFFFAOYSA-N
MW167.60 g/mol
LogP1.48
Rot. Bonds

About 6-chloro-5,6-dihydropyrido[2,3-b]pyrazine

6-chloro-5,6-dihydropyrido[2,3-b]pyrazine (PubChem CID 138740060) has the molecular formula C7H6ClN3 and a molecular weight of 167.60 g/mol. Its IUPAC name is 6-chloro-5,6-dihydropyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name6-chloro-5,6-dihydropyrido[2,3-b]pyrazine
PubChem CID138740060
Molecular FormulaC7H6ClN3
Molecular Weight167.60 g/mol
Exact Mass167.03
IUPAC Name6-chloro-5,6-dihydropyrido[2,3-b]pyrazine
SMILESClC1C=Cc2nccnc2N1
InChIInChI=1S/C7H6ClN3/c8-6-2-1-5-7(11-6)10-4-3-9-5/h1-4,6H,(H,10,11)
InChIKeyQWGOUEZVWBZEBV-UHFFFAOYSA-N
XLogP1.48
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.60
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-5,6-dihydropyrido[2,3-b]pyrazine?
The IUPAC name of 6-chloro-5,6-dihydropyrido[2,3-b]pyrazine (CID 138740060) is 6-chloro-5,6-dihydropyrido[2,3-b]pyrazine.
What is the SMILES notation for 6-chloro-5,6-dihydropyrido[2,3-b]pyrazine?
The canonical SMILES for 6-chloro-5,6-dihydropyrido[2,3-b]pyrazine is ClC1C=Cc2nccnc2N1.
What is the InChIKey of 6-chloro-5,6-dihydropyrido[2,3-b]pyrazine?
The InChIKey is QWGOUEZVWBZEBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClN3/c8-6-2-1-5-7(11-6)10-4-3-9-5/h1-4,6H,(H,10,11).
What are the key properties of 6-chloro-5,6-dihydropyrido[2,3-b]pyrazine?
6-chloro-5,6-dihydropyrido[2,3-b]pyrazine has a molecular weight of 167.60 g/mol, XLogP of 1.48, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5,6-dihydropyrido[2,3-b]pyrazine is sourced from PubChem (CID 138740060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).