5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine

C7H8N4 — CID 67361463

IUPAC5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine
SMILESNCc1cnc2[nH]ccc2n1
InChIInChI=1S/C7H8N4/c8-3-5-4-10-7-6(11-5)1-2-9-7/h1-2,4H,3,8H2,(H,9,10)
InChIKeyIHIDNIWVNPVEEC-UHFFFAOYSA-N
MW148.17 g/mol
LogP0.42
Rot. Bonds1

About 5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine

5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine (PubChem CID 67361463) has the molecular formula C7H8N4 and a molecular weight of 148.17 g/mol. Its IUPAC name is 5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine.

Molecular Properties

Compound Name5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine
PubChem CID67361463
Molecular FormulaC7H8N4
Molecular Weight148.17 g/mol
Exact Mass148.07
IUPAC Name5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine
SMILESNCc1cnc2[nH]ccc2n1
InChIInChI=1S/C7H8N4/c8-3-5-4-10-7-6(11-5)1-2-9-7/h1-2,4H,3,8H2,(H,9,10)
InChIKeyIHIDNIWVNPVEEC-UHFFFAOYSA-N
XLogP0.42
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.17
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine?
The IUPAC name of 5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine (CID 67361463) is 5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine.
What is the SMILES notation for 5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine?
The canonical SMILES for 5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine is NCc1cnc2[nH]ccc2n1.
What is the InChIKey of 5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine?
The InChIKey is IHIDNIWVNPVEEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4/c8-3-5-4-10-7-6(11-5)1-2-9-7/h1-2,4H,3,8H2,(H,9,10).
What are the key properties of 5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine?
5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine has a molecular weight of 148.17 g/mol, XLogP of 0.42, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5H-pyrrolo[2,3-b]pyrazin-2-ylmethanamine is sourced from PubChem (CID 67361463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).