2-N,2-N,4-N-triethyl-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine

C14H27N5O — CID 80861619

IUPAC2-N,2-N,4-N-triethyl-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine
SMILESCCNc1nc(OC(C)(C)CC)nc(N(CC)CC)n1
InChIInChI=1S/C14H27N5O/c1-7-14(5,6)20-13-17-11(15-8-2)16-12(18-13)19(9-3)10-4/h7-10H2,1-6H3,(H,15,16,17,18)
InChIKeyBZOYINZKNKWEKE-UHFFFAOYSA-N
MW281.40 g/mol
LogP2.72
Rot. Bonds8

About 2-N,2-N,4-N-triethyl-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine

2-N,2-N,4-N-triethyl-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine (PubChem CID 80861619) has the molecular formula C14H27N5O and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-N,2-N,4-N-triethyl-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,2-N,4-N-triethyl-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine
PubChem CID80861619
Molecular FormulaC14H27N5O
Molecular Weight281.40 g/mol
Exact Mass281.22
IUPAC Name2-N,2-N,4-N-triethyl-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine
SMILESCCNc1nc(OC(C)(C)CC)nc(N(CC)CC)n1
InChIInChI=1S/C14H27N5O/c1-7-14(5,6)20-13-17-11(15-8-2)16-12(18-13)19(9-3)10-4/h7-10H2,1-6H3,(H,15,16,17,18)
InChIKeyBZOYINZKNKWEKE-UHFFFAOYSA-N
XLogP2.72
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 52.72
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-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,2-N,4-N-triethyl-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine (CID 80861619) is 2-N,2-N,4-N-triethyl-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,2-N,4-N-triethyl-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,2-N,4-N-triethyl-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine is CCNc1nc(OC(C)(C)CC)nc(N(CC)CC)n1.
What is the InChIKey of 2-N,2-N,4-N-triethyl-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine?
The InChIKey is BZOYINZKNKWEKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N5O/c1-7-14(5,6)20-13-17-11(15-8-2)16-12(18-13)19(9-3)10-4/h7-10H2,1-6H3,(H,15,16,17,18).
What are the key properties of 2-N,2-N,4-N-triethyl-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine?
2-N,2-N,4-N-triethyl-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine has a molecular weight of 281.40 g/mol, XLogP of 2.72, 8 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-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80861619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).