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

C9H9N3 — CID 166128339

IUPAC3-cyclopropyl-5H-pyrrolo[2,3-b]pyrazine
SMILESc1cc2ncc(C3CC3)nc2[nH]1
InChIInChI=1S/C9H9N3/c1-2-6(1)8-5-11-7-3-4-10-9(7)12-8/h3-6H,1-2H2,(H,10,12)
InChIKeyVVXGGZKXHWLQQB-UHFFFAOYSA-N
MW159.19 g/mol
LogP1.84
Rot. Bonds1

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

3-cyclopropyl-5H-pyrrolo[2,3-b]pyrazine (PubChem CID 166128339) has the molecular formula C9H9N3 and a molecular weight of 159.19 g/mol. Its IUPAC name is 3-cyclopropyl-5H-pyrrolo[2,3-b]pyrazine.

Molecular Properties

Compound Name3-cyclopropyl-5H-pyrrolo[2,3-b]pyrazine
PubChem CID166128339
Molecular FormulaC9H9N3
Molecular Weight159.19 g/mol
Exact Mass159.08
IUPAC Name3-cyclopropyl-5H-pyrrolo[2,3-b]pyrazine
SMILESc1cc2ncc(C3CC3)nc2[nH]1
InChIInChI=1S/C9H9N3/c1-2-6(1)8-5-11-7-3-4-10-9(7)12-8/h3-6H,1-2H2,(H,10,12)
InChIKeyVVXGGZKXHWLQQB-UHFFFAOYSA-N
XLogP1.84
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5H-pyrrolo[2,3-b]pyrazine?
The IUPAC name of 3-cyclopropyl-5H-pyrrolo[2,3-b]pyrazine (CID 166128339) is 3-cyclopropyl-5H-pyrrolo[2,3-b]pyrazine.
What is the SMILES notation for 3-cyclopropyl-5H-pyrrolo[2,3-b]pyrazine?
The canonical SMILES for 3-cyclopropyl-5H-pyrrolo[2,3-b]pyrazine is c1cc2ncc(C3CC3)nc2[nH]1.
What is the InChIKey of 3-cyclopropyl-5H-pyrrolo[2,3-b]pyrazine?
The InChIKey is VVXGGZKXHWLQQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3/c1-2-6(1)8-5-11-7-3-4-10-9(7)12-8/h3-6H,1-2H2,(H,10,12).
What are the key properties of 3-cyclopropyl-5H-pyrrolo[2,3-b]pyrazine?
3-cyclopropyl-5H-pyrrolo[2,3-b]pyrazine has a molecular weight of 159.19 g/mol, XLogP of 1.84, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5H-pyrrolo[2,3-b]pyrazine is sourced from PubChem (CID 166128339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).