2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine

C10H20N6 — CID 80774543

IUPAC2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine
SMILESCCN(C)c1nc(N)nc(N(CC)CC)n1
InChIInChI=1S/C10H20N6/c1-5-15(4)9-12-8(11)13-10(14-9)16(6-2)7-3/h5-7H2,1-4H3,(H2,11,12,13,14)
InChIKeyYJSSWZCNBQPLLN-UHFFFAOYSA-N
MW224.31 g/mol
LogP0.76
Rot. Bonds5

About 2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine

2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine (PubChem CID 80774543) has the molecular formula C10H20N6 and a molecular weight of 224.31 g/mol. Its IUPAC name is 2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine
PubChem CID80774543
Molecular FormulaC10H20N6
Molecular Weight224.31 g/mol
Exact Mass224.17
IUPAC Name2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine
SMILESCCN(C)c1nc(N)nc(N(CC)CC)n1
InChIInChI=1S/C10H20N6/c1-5-15(4)9-12-8(11)13-10(14-9)16(6-2)7-3/h5-7H2,1-4H3,(H2,11,12,13,14)
InChIKeyYJSSWZCNBQPLLN-UHFFFAOYSA-N
XLogP0.76
TPSA71.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine (CID 80774543) is 2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine is CCN(C)c1nc(N)nc(N(CC)CC)n1.
What is the InChIKey of 2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is YJSSWZCNBQPLLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N6/c1-5-15(4)9-12-8(11)13-10(14-9)16(6-2)7-3/h5-7H2,1-4H3,(H2,11,12,13,14).
What are the key properties of 2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine?
2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 224.31 g/mol, XLogP of 0.76, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 80774543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).