4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

C11H19N5OS — CID 6491507

IUPAC4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCCSc1nc(N(C)C)nc(N2CCOCC2)n1
InChIInChI=1S/C11H19N5OS/c1-4-18-11-13-9(15(2)3)12-10(14-11)16-5-7-17-8-6-16/h4-8H2,1-3H3
InChIKeyOODGYSLXKKZFOZ-UHFFFAOYSA-N
MW269.37 g/mol
LogP0.89
Rot. Bonds4

About 4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 6491507) has the molecular formula C11H19N5OS and a molecular weight of 269.37 g/mol. Its IUPAC name is 4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID6491507
Molecular FormulaC11H19N5OS
Molecular Weight269.37 g/mol
Exact Mass269.13
IUPAC Name4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCCSc1nc(N(C)C)nc(N2CCOCC2)n1
InChIInChI=1S/C11H19N5OS/c1-4-18-11-13-9(15(2)3)12-10(14-11)16-5-7-17-8-6-16/h4-8H2,1-3H3
InChIKeyOODGYSLXKKZFOZ-UHFFFAOYSA-N
XLogP0.89
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (CID 6491507) is 4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is CCSc1nc(N(C)C)nc(N2CCOCC2)n1.
What is the InChIKey of 4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is OODGYSLXKKZFOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5OS/c1-4-18-11-13-9(15(2)3)12-10(14-11)16-5-7-17-8-6-16/h4-8H2,1-3H3.
What are the key properties of 4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 269.37 g/mol, XLogP of 0.89, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylsulfanyl-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 6491507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).