2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine

C8H14N4 — CID 82467981

IUPAC2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine
SMILESCc1nc(C)nc(C(C)(C)N)n1
InChIInChI=1S/C8H14N4/c1-5-10-6(2)12-7(11-5)8(3,4)9/h9H2,1-4H3
InChIKeyZPUXMJWMTZXSGA-UHFFFAOYSA-N
MW166.23 g/mol
LogP0.68
Rot. Bonds1

About 2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine

2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine (PubChem CID 82467981) has the molecular formula C8H14N4 and a molecular weight of 166.23 g/mol. Its IUPAC name is 2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine.

Molecular Properties

Compound Name2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine
PubChem CID82467981
Molecular FormulaC8H14N4
Molecular Weight166.23 g/mol
Exact Mass166.12
IUPAC Name2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine
SMILESCc1nc(C)nc(C(C)(C)N)n1
InChIInChI=1S/C8H14N4/c1-5-10-6(2)12-7(11-5)8(3,4)9/h9H2,1-4H3
InChIKeyZPUXMJWMTZXSGA-UHFFFAOYSA-N
XLogP0.68
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.23
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine?
The IUPAC name of 2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine (CID 82467981) is 2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine.
What is the SMILES notation for 2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine?
The canonical SMILES for 2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine is Cc1nc(C)nc(C(C)(C)N)n1.
What is the InChIKey of 2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine?
The InChIKey is ZPUXMJWMTZXSGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4/c1-5-10-6(2)12-7(11-5)8(3,4)9/h9H2,1-4H3.
What are the key properties of 2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine?
2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine has a molecular weight of 166.23 g/mol, XLogP of 0.68, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-amine is sourced from PubChem (CID 82467981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).