3H-pyrazino[2,3-d]quinoline

C11H9N3 — CID 57152003

IUPAC3H-pyrazino[2,3-d]quinoline
SMILESC1=CC2=NC=CC3=NCC=NC23C=C1
InChIInChI=1S/C11H9N3/c1-2-5-11-9(3-1)12-6-4-10(11)13-7-8-14-11/h1-6,8H,7H2
InChIKeyIUGCHFWYZFFTFL-UHFFFAOYSA-N
MW183.21 g/mol
LogP1.34
Rot. Bonds

About 3H-pyrazino[2,3-d]quinoline

3H-pyrazino[2,3-d]quinoline (PubChem CID 57152003) has the molecular formula C11H9N3 and a molecular weight of 183.21 g/mol. Its IUPAC name is 3H-pyrazino[2,3-d]quinoline.

Molecular Properties

Compound Name3H-pyrazino[2,3-d]quinoline
PubChem CID57152003
Molecular FormulaC11H9N3
Molecular Weight183.21 g/mol
Exact Mass183.08
IUPAC Name3H-pyrazino[2,3-d]quinoline
SMILESC1=CC2=NC=CC3=NCC=NC23C=C1
InChIInChI=1S/C11H9N3/c1-2-5-11-9(3-1)12-6-4-10(11)13-7-8-14-11/h1-6,8H,7H2
InChIKeyIUGCHFWYZFFTFL-UHFFFAOYSA-N
XLogP1.34
TPSA37.08 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3H-pyrazino[2,3-d]quinoline?
The IUPAC name of 3H-pyrazino[2,3-d]quinoline (CID 57152003) is 3H-pyrazino[2,3-d]quinoline.
What is the SMILES notation for 3H-pyrazino[2,3-d]quinoline?
The canonical SMILES for 3H-pyrazino[2,3-d]quinoline is C1=CC2=NC=CC3=NCC=NC23C=C1.
What is the InChIKey of 3H-pyrazino[2,3-d]quinoline?
The InChIKey is IUGCHFWYZFFTFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3/c1-2-5-11-9(3-1)12-6-4-10(11)13-7-8-14-11/h1-6,8H,7H2.
What are the key properties of 3H-pyrazino[2,3-d]quinoline?
3H-pyrazino[2,3-d]quinoline has a molecular weight of 183.21 g/mol, XLogP of 1.34, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3H-pyrazino[2,3-d]quinoline is sourced from PubChem (CID 57152003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).