6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine

C8H16N6 — CID 159289630

IUPAC6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(N)nc(C(C)N(C)C)n1
InChIInChI=1S/C8H16N6/c1-5(14(3)4)6-11-7(9)13-8(10-2)12-6/h5H,1-4H3,(H3,9,10,11,12,13)
InChIKeyKZYGAFJLNOHUBA-UHFFFAOYSA-N
MW196.26 g/mol
LogP0.12
Rot. Bonds3

About 6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine

6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine (PubChem CID 159289630) has the molecular formula C8H16N6 and a molecular weight of 196.26 g/mol. Its IUPAC name is 6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine
PubChem CID159289630
Molecular FormulaC8H16N6
Molecular Weight196.26 g/mol
Exact Mass196.14
IUPAC Name6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(N)nc(C(C)N(C)C)n1
InChIInChI=1S/C8H16N6/c1-5(14(3)4)6-11-7(9)13-8(10-2)12-6/h5H,1-4H3,(H3,9,10,11,12,13)
InChIKeyKZYGAFJLNOHUBA-UHFFFAOYSA-N
XLogP0.12
TPSA79.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.26
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine (CID 159289630) is 6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine is CNc1nc(N)nc(C(C)N(C)C)n1.
What is the InChIKey of 6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine?
The InChIKey is KZYGAFJLNOHUBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N6/c1-5(14(3)4)6-11-7(9)13-8(10-2)12-6/h5H,1-4H3,(H3,9,10,11,12,13).
What are the key properties of 6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine?
6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine has a molecular weight of 196.26 g/mol, XLogP of 0.12, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(dimethylamino)ethyl]-2-N-methyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 159289630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).