2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine

C11H18N4OS — CID 69104205

IUPAC2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine
SMILESCc1nc(N)cc(SCCN2CCOCC2)n1
InChIInChI=1S/C11H18N4OS/c1-9-13-10(12)8-11(14-9)17-7-4-15-2-5-16-6-3-15/h8H,2-7H2,1H3,(H2,12,13,14)
InChIKeyGOZXWCAYOGXYAZ-UHFFFAOYSA-N
MW254.36 g/mol
LogP0.79
Rot. Bonds4

About 2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine

2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine (PubChem CID 69104205) has the molecular formula C11H18N4OS and a molecular weight of 254.36 g/mol. Its IUPAC name is 2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine
PubChem CID69104205
Molecular FormulaC11H18N4OS
Molecular Weight254.36 g/mol
Exact Mass254.12
IUPAC Name2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine
SMILESCc1nc(N)cc(SCCN2CCOCC2)n1
InChIInChI=1S/C11H18N4OS/c1-9-13-10(12)8-11(14-9)17-7-4-15-2-5-16-6-3-15/h8H,2-7H2,1H3,(H2,12,13,14)
InChIKeyGOZXWCAYOGXYAZ-UHFFFAOYSA-N
XLogP0.79
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.36
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine?
The IUPAC name of 2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine (CID 69104205) is 2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine.
What is the SMILES notation for 2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine?
The canonical SMILES for 2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine is Cc1nc(N)cc(SCCN2CCOCC2)n1.
What is the InChIKey of 2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine?
The InChIKey is GOZXWCAYOGXYAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4OS/c1-9-13-10(12)8-11(14-9)17-7-4-15-2-5-16-6-3-15/h8H,2-7H2,1H3,(H2,12,13,14).
What are the key properties of 2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine?
2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine has a molecular weight of 254.36 g/mol, XLogP of 0.79, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-amine is sourced from PubChem (CID 69104205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).