4,6-dimethyl-1,3,5-triazin-2-amine

C5H8N4 — CID 15820

IUPAC4,6-dimethyl-1,3,5-triazin-2-amine
SMILESCc1nc(C)nc(N)n1
InChIInChI=1S/C5H8N4/c1-3-7-4(2)9-5(6)8-3/h1-2H3,(H2,6,7,8,9)
InChIKeyVQZRXBOTCNWNLM-UHFFFAOYSA-N
MW124.15 g/mol
LogP0.07
Rot. Bonds

About 4,6-dimethyl-1,3,5-triazin-2-amine

4,6-dimethyl-1,3,5-triazin-2-amine (PubChem CID 15820) has the molecular formula C5H8N4 and a molecular weight of 124.15 g/mol. Its IUPAC name is 4,6-dimethyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4,6-dimethyl-1,3,5-triazin-2-amine
PubChem CID15820
Molecular FormulaC5H8N4
Molecular Weight124.15 g/mol
Exact Mass124.07
IUPAC Name4,6-dimethyl-1,3,5-triazin-2-amine
SMILESCc1nc(C)nc(N)n1
InChIInChI=1S/C5H8N4/c1-3-7-4(2)9-5(6)8-3/h1-2H3,(H2,6,7,8,9)
InChIKeyVQZRXBOTCNWNLM-UHFFFAOYSA-N
XLogP0.07
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.15
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-1,3,5-triazin-2-amine?
The IUPAC name of 4,6-dimethyl-1,3,5-triazin-2-amine (CID 15820) is 4,6-dimethyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4,6-dimethyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4,6-dimethyl-1,3,5-triazin-2-amine is Cc1nc(C)nc(N)n1.
What is the InChIKey of 4,6-dimethyl-1,3,5-triazin-2-amine?
The InChIKey is VQZRXBOTCNWNLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4/c1-3-7-4(2)9-5(6)8-3/h1-2H3,(H2,6,7,8,9).
What are the key properties of 4,6-dimethyl-1,3,5-triazin-2-amine?
4,6-dimethyl-1,3,5-triazin-2-amine has a molecular weight of 124.15 g/mol, XLogP of 0.07, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 15820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).