6H-cyclopenta[b]pyrazine

C7H6N2 — CID 59844085

IUPAC6H-cyclopenta[b]pyrazine
SMILESC1=c2nccnc2=CC1
InChIInChI=1S/C7H6N2/c1-2-6-7(3-1)9-5-4-8-6/h2-5H,1H2
InChIKeyQRWVPDVPTAVORS-UHFFFAOYSA-N
MW118.14 g/mol
LogP-0.56
Rot. Bonds

About 6H-cyclopenta[b]pyrazine

6H-cyclopenta[b]pyrazine (PubChem CID 59844085) has the molecular formula C7H6N2 and a molecular weight of 118.14 g/mol. Its IUPAC name is 6H-cyclopenta[b]pyrazine.

Molecular Properties

Compound Name6H-cyclopenta[b]pyrazine
PubChem CID59844085
Molecular FormulaC7H6N2
Molecular Weight118.14 g/mol
Exact Mass118.05
IUPAC Name6H-cyclopenta[b]pyrazine
SMILESC1=c2nccnc2=CC1
InChIInChI=1S/C7H6N2/c1-2-6-7(3-1)9-5-4-8-6/h2-5H,1H2
InChIKeyQRWVPDVPTAVORS-UHFFFAOYSA-N
XLogP-0.56
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.14
LogP ≤ 5-0.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4H-Pyrrolo[3,2-C]pyridine
CID 56972344
5-methyl-6H-cyclopenta[b]pyrazine
CID 59467405
N-[6-(methylideneamino)cyclohexa-1,5-dien-1-yl]ethanimine
CID 68360465
(2E,3E)-2-ethylidene-3-propylidenepyrazine
CID 88952359
7aH-pyrrolo[3,2-b]pyridine
CID 153453924
2-Methyl-6H-pyrrolo[3,2-b]pyridine
CID 15581318
6H-Pyrrolo[3,2-C]pyridine
CID 56972351

Frequently Asked Questions

What is the IUPAC name of 6H-cyclopenta[b]pyrazine?
The IUPAC name of 6H-cyclopenta[b]pyrazine (CID 59844085) is 6H-cyclopenta[b]pyrazine.
What is the SMILES notation for 6H-cyclopenta[b]pyrazine?
The canonical SMILES for 6H-cyclopenta[b]pyrazine is C1=c2nccnc2=CC1.
What is the InChIKey of 6H-cyclopenta[b]pyrazine?
The InChIKey is QRWVPDVPTAVORS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2/c1-2-6-7(3-1)9-5-4-8-6/h2-5H,1H2.
What are the key properties of 6H-cyclopenta[b]pyrazine?
6H-cyclopenta[b]pyrazine has a molecular weight of 118.14 g/mol, XLogP of -0.56, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6H-cyclopenta[b]pyrazine is sourced from PubChem (CID 59844085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).