N,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine

C13H14N4 — CID 12746713

IUPACN,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine
SMILESCc1cc2cnc3ccc(N(C)C)cc3n2n1
InChIInChI=1S/C13H14N4/c1-9-6-11-8-14-12-5-4-10(16(2)3)7-13(12)17(11)15-9/h4-8H,1-3H3
InChIKeyYKSQFDNHIQPFJA-UHFFFAOYSA-N
MW226.28 g/mol
LogP2.26
Rot. Bonds1

About N,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine

N,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine (PubChem CID 12746713) has the molecular formula C13H14N4 and a molecular weight of 226.28 g/mol. Its IUPAC name is N,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine.

Molecular Properties

Compound NameN,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine
PubChem CID12746713
Molecular FormulaC13H14N4
Molecular Weight226.28 g/mol
Exact Mass226.12
IUPAC NameN,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine
SMILESCc1cc2cnc3ccc(N(C)C)cc3n2n1
InChIInChI=1S/C13H14N4/c1-9-6-11-8-14-12-5-4-10(16(2)3)7-13(12)17(11)15-9/h4-8H,1-3H3
InChIKeyYKSQFDNHIQPFJA-UHFFFAOYSA-N
XLogP2.26
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine?
The IUPAC name of N,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine (CID 12746713) is N,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine.
What is the SMILES notation for N,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine?
The canonical SMILES for N,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine is Cc1cc2cnc3ccc(N(C)C)cc3n2n1.
What is the InChIKey of N,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine?
The InChIKey is YKSQFDNHIQPFJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4/c1-9-6-11-8-14-12-5-4-10(16(2)3)7-13(12)17(11)15-9/h4-8H,1-3H3.
What are the key properties of N,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine?
N,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine has a molecular weight of 226.28 g/mol, XLogP of 2.26, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethylpyrazolo[1,5-a]quinoxalin-8-amine is sourced from PubChem (CID 12746713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).