3-fluoro-5H-pyrrolo[2,3-b]pyrazine

C6H4FN3 — CID 171409977

IUPAC3-fluoro-5H-pyrrolo[2,3-b]pyrazine
SMILESFc1cnc2cc[nH]c2n1
InChIInChI=1S/C6H4FN3/c7-5-3-9-4-1-2-8-6(4)10-5/h1-3H,(H,8,10)
InChIKeySIEAPKFLEJQSQV-UHFFFAOYSA-N
MW137.12 g/mol
LogP1.10
Rot. Bonds

About 3-fluoro-5H-pyrrolo[2,3-b]pyrazine

3-fluoro-5H-pyrrolo[2,3-b]pyrazine (PubChem CID 171409977) has the molecular formula C6H4FN3 and a molecular weight of 137.12 g/mol. Its IUPAC name is 3-fluoro-5H-pyrrolo[2,3-b]pyrazine.

Molecular Properties

Compound Name3-fluoro-5H-pyrrolo[2,3-b]pyrazine
PubChem CID171409977
Molecular FormulaC6H4FN3
Molecular Weight137.12 g/mol
Exact Mass137.04
IUPAC Name3-fluoro-5H-pyrrolo[2,3-b]pyrazine
SMILESFc1cnc2cc[nH]c2n1
InChIInChI=1S/C6H4FN3/c7-5-3-9-4-1-2-8-6(4)10-5/h1-3H,(H,8,10)
InChIKeySIEAPKFLEJQSQV-UHFFFAOYSA-N
XLogP1.10
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.12
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5H-Pyrrolo(3,2-d)pyrimidin-4-amine
CID 5287565
7-Deazaadenine
CID 5359620
Imidazo(4,5-b)pyridine
CID 67504
7H-Pyrrolo(2,3-d)pyrimidine
CID 261591
5H-Pyrrolo[2,3-b]pyrazine
CID 5370803
1H-Imidazo(4,5-c)pyridine
CID 9227
3-Deazaadenine
CID 418745
3H-imidazo(4,5-b)pyridin-7-amine
CID 3879010
2-Methyl-3H-imidazo(4,5-c)pyridine
CID 373077
1-cyclohexyl-3-(5H-pyrrolo[2,3-b]pyrazin-2-yl)urea
CID 46235625
1-(5H-pyrrolo[2,3-b]pyrazin-2-yl)-3-[1-(2,2,2-trifluoroethyl)piperidin-3-yl]urea
CID 46235942
2-(Trifluoromethyl)-3H-imidazo[4,5-c]pyridine
CID 604479

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-5H-pyrrolo[2,3-b]pyrazine?
The IUPAC name of 3-fluoro-5H-pyrrolo[2,3-b]pyrazine (CID 171409977) is 3-fluoro-5H-pyrrolo[2,3-b]pyrazine.
What is the SMILES notation for 3-fluoro-5H-pyrrolo[2,3-b]pyrazine?
The canonical SMILES for 3-fluoro-5H-pyrrolo[2,3-b]pyrazine is Fc1cnc2cc[nH]c2n1.
What is the InChIKey of 3-fluoro-5H-pyrrolo[2,3-b]pyrazine?
The InChIKey is SIEAPKFLEJQSQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4FN3/c7-5-3-9-4-1-2-8-6(4)10-5/h1-3H,(H,8,10).
What are the key properties of 3-fluoro-5H-pyrrolo[2,3-b]pyrazine?
3-fluoro-5H-pyrrolo[2,3-b]pyrazine has a molecular weight of 137.12 g/mol, XLogP of 1.10, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-5H-pyrrolo[2,3-b]pyrazine is sourced from PubChem (CID 171409977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).