N-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine

C10H9N5 — CID 13385680

IUPACN-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
SMILESCNc1nc2ccccc2n2cnnc12
InChIInChI=1S/C10H9N5/c1-11-9-10-14-12-6-15(10)8-5-3-2-4-7(8)13-9/h2-6H,1H3,(H,11,13)
InChIKeyOKMBFCGUSTURFV-UHFFFAOYSA-N
MW199.22 g/mol
LogP1.32
Rot. Bonds1

About N-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine

N-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine (PubChem CID 13385680) has the molecular formula C10H9N5 and a molecular weight of 199.22 g/mol. Its IUPAC name is N-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine.

Molecular Properties

Compound NameN-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
PubChem CID13385680
Molecular FormulaC10H9N5
Molecular Weight199.22 g/mol
Exact Mass199.09
IUPAC NameN-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
SMILESCNc1nc2ccccc2n2cnnc12
InChIInChI=1S/C10H9N5/c1-11-9-10-14-12-6-15(10)8-5-3-2-4-7(8)13-9/h2-6H,1H3,(H,11,13)
InChIKeyOKMBFCGUSTURFV-UHFFFAOYSA-N
XLogP1.32
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.22
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine?
The IUPAC name of N-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine (CID 13385680) is N-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine.
What is the SMILES notation for N-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine?
The canonical SMILES for N-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine is CNc1nc2ccccc2n2cnnc12.
What is the InChIKey of N-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine?
The InChIKey is OKMBFCGUSTURFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N5/c1-11-9-10-14-12-6-15(10)8-5-3-2-4-7(8)13-9/h2-6H,1H3,(H,11,13).
What are the key properties of N-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine?
N-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine has a molecular weight of 199.22 g/mol, XLogP of 1.32, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine is sourced from PubChem (CID 13385680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).