4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine

C6H12N6 — CID 118343887

IUPAC4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine
SMILESCNc1nc(CN)nc(CN)n1
InChIInChI=1S/C6H12N6/c1-9-6-11-4(2-7)10-5(3-8)12-6/h2-3,7-8H2,1H3,(H,9,10,11,12)
InChIKeyATUAIHRIWNSBJT-UHFFFAOYSA-N
MW168.20 g/mol
LogP-1.17
Rot. Bonds3

About 4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine

4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine (PubChem CID 118343887) has the molecular formula C6H12N6 and a molecular weight of 168.20 g/mol. Its IUPAC name is 4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine
PubChem CID118343887
Molecular FormulaC6H12N6
Molecular Weight168.20 g/mol
Exact Mass168.11
IUPAC Name4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine
SMILESCNc1nc(CN)nc(CN)n1
InChIInChI=1S/C6H12N6/c1-9-6-11-4(2-7)10-5(3-8)12-6/h2-3,7-8H2,1H3,(H,9,10,11,12)
InChIKeyATUAIHRIWNSBJT-UHFFFAOYSA-N
XLogP-1.17
TPSA102.74 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 5-1.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

1,3,5-Triazin-2-amine, 4-methoxy-N,6-dimethyl-
CID 160779
Dimethyl-1,3,5-triazin-2-amine
CID 15820
N~2~,N~4~-Diethyl-6-methyl-1,3,5-triazine-2,4-diamine
CID 16086
Emd-90076
CID 592622
4-Methyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine
CID 63868018
N-ethyl-4-methyl-6-(trichloromethyl)-1,3,5-triazin-2-amine
CID 32660
s-Triazine, 2-methyl-4-methylamino-6-(trifluoromethyl)-
CID 3041947
1,3,5-Triazin-2-amine, N-ethyl-4-methyl-6-(trifluoromethyl)-
CID 3041968
4-Chloro-N,6-dimethyl-1,3,5-triazin-2-amine
CID 12237262
4-Methoxy-6-methyl-1,3,5-triazin-2-methylamine
CID 15515077
N~2~,N~4~,6-Trimethyl-1,3,5-triazine-2,4-diamine
CID 16085
4,6-Bis(ethylamino)-1,3,5-triazine-2-carbonitrile
CID 30245

Frequently Asked Questions

What is the IUPAC name of 4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine?
The IUPAC name of 4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine (CID 118343887) is 4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine is CNc1nc(CN)nc(CN)n1.
What is the InChIKey of 4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine?
The InChIKey is ATUAIHRIWNSBJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N6/c1-9-6-11-4(2-7)10-5(3-8)12-6/h2-3,7-8H2,1H3,(H,9,10,11,12).
What are the key properties of 4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine?
4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine has a molecular weight of 168.20 g/mol, XLogP of -1.17, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-bis(aminomethyl)-N-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 118343887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).