6-(methylideneamino)-1,3,5-triazine-2,4-diamine

C4H6N6 — CID 23514485

IUPAC6-(methylideneamino)-1,3,5-triazine-2,4-diamine
SMILESC=Nc1nc(N)nc(N)n1
InChIInChI=1S/C4H6N6/c1-7-4-9-2(5)8-3(6)10-4/h1H2,(H4,5,6,8,9,10)
InChIKeyDZBIMLCMMYGJFY-UHFFFAOYSA-N
MW138.13 g/mol
LogP-0.63
Rot. Bonds1

About 6-(methylideneamino)-1,3,5-triazine-2,4-diamine

6-(methylideneamino)-1,3,5-triazine-2,4-diamine (PubChem CID 23514485) has the molecular formula C4H6N6 and a molecular weight of 138.13 g/mol. Its IUPAC name is 6-(methylideneamino)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-(methylideneamino)-1,3,5-triazine-2,4-diamine
PubChem CID23514485
Molecular FormulaC4H6N6
Molecular Weight138.13 g/mol
Exact Mass138.07
IUPAC Name6-(methylideneamino)-1,3,5-triazine-2,4-diamine
SMILESC=Nc1nc(N)nc(N)n1
InChIInChI=1S/C4H6N6/c1-7-4-9-2(5)8-3(6)10-4/h1H2,(H4,5,6,8,9,10)
InChIKeyDZBIMLCMMYGJFY-UHFFFAOYSA-N
XLogP-0.63
TPSA103.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.13
LogP ≤ 5-0.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

Melamine
CID 7955
N,N-Dimethylmelamine
CID 16134
1,3,5-Triazine-2,4-diamine
CID 10435
1,3,5-Triazin-2-amine
CID 20077
2-Amino-4,6-bis(dimethylamino)-1,3,5-triazine
CID 17805
1,3,5-Triazine-2,4,6-triamine, hydrobromide (1:?)
CID 12219208
Guanylmelamine
CID 428203
Melamine-d6
CID 45039688
Cyanomelamine
CID 592015
1,3,5-Triazine-2,4,6-(~15~N_3_)triamine
CID 46782115
(~13~C_3_)-1,3,5-Triazine-2,4,6-triamine
CID 71309406
Melamine hydrogen flouride
CID 12219207

Frequently Asked Questions

What is the IUPAC name of 6-(methylideneamino)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-(methylideneamino)-1,3,5-triazine-2,4-diamine (CID 23514485) is 6-(methylideneamino)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-(methylideneamino)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-(methylideneamino)-1,3,5-triazine-2,4-diamine is C=Nc1nc(N)nc(N)n1.
What is the InChIKey of 6-(methylideneamino)-1,3,5-triazine-2,4-diamine?
The InChIKey is DZBIMLCMMYGJFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N6/c1-7-4-9-2(5)8-3(6)10-4/h1H2,(H4,5,6,8,9,10).
What are the key properties of 6-(methylideneamino)-1,3,5-triazine-2,4-diamine?
6-(methylideneamino)-1,3,5-triazine-2,4-diamine has a molecular weight of 138.13 g/mol, XLogP of -0.63, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methylideneamino)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 23514485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).