5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine

C16H14N6 — CID 166372711

IUPAC5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine
SMILESCNc1ccc(Nc2nc3ccccc3n3cncc23)cn1
InChIInChI=1S/C16H14N6/c1-17-15-7-6-11(8-19-15)20-16-14-9-18-10-22(14)13-5-3-2-4-12(13)21-16/h2-10H,1H3,(H,17,19)(H,20,21)
InChIKeyDGUXOBHMFJQHLQ-UHFFFAOYSA-N
MW290.33 g/mol
LogP3.06
Rot. Bonds3

About 5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine

5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine (PubChem CID 166372711) has the molecular formula C16H14N6 and a molecular weight of 290.33 g/mol. Its IUPAC name is 5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine.

Molecular Properties

Compound Name5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine
PubChem CID166372711
Molecular FormulaC16H14N6
Molecular Weight290.33 g/mol
Exact Mass290.13
IUPAC Name5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine
SMILESCNc1ccc(Nc2nc3ccccc3n3cncc23)cn1
InChIInChI=1S/C16H14N6/c1-17-15-7-6-11(8-19-15)20-16-14-9-18-10-22(14)13-5-3-2-4-12(13)21-16/h2-10H,1H3,(H,17,19)(H,20,21)
InChIKeyDGUXOBHMFJQHLQ-UHFFFAOYSA-N
XLogP3.06
TPSA67.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine?
The IUPAC name of 5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine (CID 166372711) is 5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine.
What is the SMILES notation for 5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine?
The canonical SMILES for 5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine is CNc1ccc(Nc2nc3ccccc3n3cncc23)cn1.
What is the InChIKey of 5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine?
The InChIKey is DGUXOBHMFJQHLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N6/c1-17-15-7-6-11(8-19-15)20-16-14-9-18-10-22(14)13-5-3-2-4-12(13)21-16/h2-10H,1H3,(H,17,19)(H,20,21).
What are the key properties of 5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine?
5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine has a molecular weight of 290.33 g/mol, XLogP of 3.06, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-imidazo[1,5-a]quinoxalin-4-yl-2-N-methylpyridine-2,5-diamine is sourced from PubChem (CID 166372711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).