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

C11H11N5 — CID 6622993

IUPACN,N-dimethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
SMILESCN(C)c1nc2ccccc2n2cnnc12
InChIInChI=1S/C11H11N5/c1-15(2)10-11-14-12-7-16(11)9-6-4-3-5-8(9)13-10/h3-7H,1-2H3
InChIKeyQODXOYXKSDVVFD-UHFFFAOYSA-N
MW213.24 g/mol
LogP1.34
Rot. Bonds1

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

N,N-dimethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine (PubChem CID 6622993) has the molecular formula C11H11N5 and a molecular weight of 213.24 g/mol. Its IUPAC name is N,N-dimethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
PubChem CID6622993
Molecular FormulaC11H11N5
Molecular Weight213.24 g/mol
Exact Mass213.10
IUPAC NameN,N-dimethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
SMILESCN(C)c1nc2ccccc2n2cnnc12
InChIInChI=1S/C11H11N5/c1-15(2)10-11-14-12-7-16(11)9-6-4-3-5-8(9)13-10/h3-7H,1-2H3
InChIKeyQODXOYXKSDVVFD-UHFFFAOYSA-N
XLogP1.34
TPSA46.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine?
The IUPAC name of N,N-dimethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine (CID 6622993) is N,N-dimethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine.
What is the SMILES notation for N,N-dimethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine?
The canonical SMILES for N,N-dimethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine is CN(C)c1nc2ccccc2n2cnnc12.
What is the InChIKey of N,N-dimethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine?
The InChIKey is QODXOYXKSDVVFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5/c1-15(2)10-11-14-12-7-16(11)9-6-4-3-5-8(9)13-10/h3-7H,1-2H3.
What are the key properties of N,N-dimethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine?
N,N-dimethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine has a molecular weight of 213.24 g/mol, XLogP of 1.34, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine is sourced from PubChem (CID 6622993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).