5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline

C10H9N3 — CID 138756856

IUPAC5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline
SMILESC1=NC2=c3cc[nH]c3=CCC2=NC1
InChIInChI=1S/C10H9N3/c1-2-9-10(13-6-5-12-9)7-3-4-11-8(1)7/h1,3-4,6,11H,2,5H2
InChIKeyGJIHOHPDVVHQMB-UHFFFAOYSA-N
MW171.20 g/mol
LogP-0.17
Rot. Bonds

About 5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline

5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline (PubChem CID 138756856) has the molecular formula C10H9N3 and a molecular weight of 171.20 g/mol. Its IUPAC name is 5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline.

Molecular Properties

Compound Name5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline
PubChem CID138756856
Molecular FormulaC10H9N3
Molecular Weight171.20 g/mol
Exact Mass171.08
IUPAC Name5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline
SMILESC1=NC2=c3cc[nH]c3=CCC2=NC1
InChIInChI=1S/C10H9N3/c1-2-9-10(13-6-5-12-9)7-3-4-11-8(1)7/h1,3-4,6,11H,2,5H2
InChIKeyGJIHOHPDVVHQMB-UHFFFAOYSA-N
XLogP-0.17
TPSA40.51 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline?
The IUPAC name of 5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline (CID 138756856) is 5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline.
What is the SMILES notation for 5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline?
The canonical SMILES for 5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline is C1=NC2=c3cc[nH]c3=CCC2=NC1.
What is the InChIKey of 5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline?
The InChIKey is GJIHOHPDVVHQMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3/c1-2-9-10(13-6-5-12-9)7-3-4-11-8(1)7/h1,3-4,6,11H,2,5H2.
What are the key properties of 5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline?
5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline has a molecular weight of 171.20 g/mol, XLogP of -0.17, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dihydro-3H-pyrrolo[3,2-f]quinoxaline is sourced from PubChem (CID 138756856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).