N-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine

C6H12N6 — CID 71476443

IUPACN-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine
SMILESCNCc1nnc(CNC)nn1
InChIInChI=1S/C6H12N6/c1-7-3-5-9-11-6(4-8-2)12-10-5/h7-8H,3-4H2,1-2H3
InChIKeyNOZDPAKWPGLLJU-UHFFFAOYSA-N
MW168.20 g/mol
LogP-1.29
Rot. Bonds4

About N-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine

N-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine (PubChem CID 71476443) has the molecular formula C6H12N6 and a molecular weight of 168.20 g/mol. Its IUPAC name is N-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine
PubChem CID71476443
Molecular FormulaC6H12N6
Molecular Weight168.20 g/mol
Exact Mass168.11
IUPAC NameN-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine
SMILESCNCc1nnc(CNC)nn1
InChIInChI=1S/C6H12N6/c1-7-3-5-9-11-6(4-8-2)12-10-5/h7-8H,3-4H2,1-2H3
InChIKeyNOZDPAKWPGLLJU-UHFFFAOYSA-N
XLogP-1.29
TPSA75.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 5-1.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine?
The IUPAC name of N-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine (CID 71476443) is N-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine.
What is the SMILES notation for N-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine?
The canonical SMILES for N-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine is CNCc1nnc(CNC)nn1.
What is the InChIKey of N-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine?
The InChIKey is NOZDPAKWPGLLJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N6/c1-7-3-5-9-11-6(4-8-2)12-10-5/h7-8H,3-4H2,1-2H3.
What are the key properties of N-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine?
N-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine has a molecular weight of 168.20 g/mol, XLogP of -1.29, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[6-(methylaminomethyl)-1,2,4,5-tetrazin-3-yl]methanamine is sourced from PubChem (CID 71476443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).