5,6-dichloro-1H-imidazo[4,5-b]pyrazine

C5H2Cl2N4 — CID 6185514

IUPAC5,6-dichloro-1H-imidazo[4,5-b]pyrazine
SMILESClc1nc2nc[nH]c2nc1Cl
InChIInChI=1S/C5H2Cl2N4/c6-2-3(7)11-5-4(10-2)8-1-9-5/h1H,(H,8,9,10,11)
InChIKeyMIQQJOMFMVDFTH-UHFFFAOYSA-N
MW189.01 g/mol
LogP1.66
Rot. Bonds

About 5,6-dichloro-1H-imidazo[4,5-b]pyrazine

5,6-dichloro-1H-imidazo[4,5-b]pyrazine (PubChem CID 6185514) has the molecular formula C5H2Cl2N4 and a molecular weight of 189.01 g/mol. Its IUPAC name is 5,6-dichloro-1H-imidazo[4,5-b]pyrazine.

Molecular Properties

Compound Name5,6-dichloro-1H-imidazo[4,5-b]pyrazine
PubChem CID6185514
Molecular FormulaC5H2Cl2N4
Molecular Weight189.01 g/mol
Exact Mass187.97
IUPAC Name5,6-dichloro-1H-imidazo[4,5-b]pyrazine
SMILESClc1nc2nc[nH]c2nc1Cl
InChIInChI=1S/C5H2Cl2N4/c6-2-3(7)11-5-4(10-2)8-1-9-5/h1H,(H,8,9,10,11)
InChIKeyMIQQJOMFMVDFTH-UHFFFAOYSA-N
XLogP1.66
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.01
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,6-dichloro-1H-imidazo[4,5-b]pyrazine?
The IUPAC name of 5,6-dichloro-1H-imidazo[4,5-b]pyrazine (CID 6185514) is 5,6-dichloro-1H-imidazo[4,5-b]pyrazine.
What is the SMILES notation for 5,6-dichloro-1H-imidazo[4,5-b]pyrazine?
The canonical SMILES for 5,6-dichloro-1H-imidazo[4,5-b]pyrazine is Clc1nc2nc[nH]c2nc1Cl.
What is the InChIKey of 5,6-dichloro-1H-imidazo[4,5-b]pyrazine?
The InChIKey is MIQQJOMFMVDFTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H2Cl2N4/c6-2-3(7)11-5-4(10-2)8-1-9-5/h1H,(H,8,9,10,11).
What are the key properties of 5,6-dichloro-1H-imidazo[4,5-b]pyrazine?
5,6-dichloro-1H-imidazo[4,5-b]pyrazine has a molecular weight of 189.01 g/mol, XLogP of 1.66, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dichloro-1H-imidazo[4,5-b]pyrazine is sourced from PubChem (CID 6185514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).