4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

C12H19N5O2S — CID 107765184

IUPAC4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCC1OCCC1Sc1nc(N)nc(N2CCOCC2)n1
InChIInChI=1S/C12H19N5O2S/c1-8-9(2-5-19-8)20-12-15-10(13)14-11(16-12)17-3-6-18-7-4-17/h8-9H,2-7H2,1H3,(H2,13,14,15,16)
InChIKeyDLMHNHDFAGUOSN-UHFFFAOYSA-N
MW297.38 g/mol
LogP0.56
Rot. Bonds3

About 4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 107765184) has the molecular formula C12H19N5O2S and a molecular weight of 297.38 g/mol. Its IUPAC name is 4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID107765184
Molecular FormulaC12H19N5O2S
Molecular Weight297.38 g/mol
Exact Mass297.13
IUPAC Name4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCC1OCCC1Sc1nc(N)nc(N2CCOCC2)n1
InChIInChI=1S/C12H19N5O2S/c1-8-9(2-5-19-8)20-12-15-10(13)14-11(16-12)17-3-6-18-7-4-17/h8-9H,2-7H2,1H3,(H2,13,14,15,16)
InChIKeyDLMHNHDFAGUOSN-UHFFFAOYSA-N
XLogP0.56
TPSA86.39 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

4-morpholin-4-yl-6-propan-2-ylsulfanyl-1,3,5-triazin-2-amine
CID 80885930
4-(2-methylmorpholin-4-yl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80764638
4-N,4-N-dimethyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 27396187
4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 106928670
4-(azepan-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80764187
4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine
CID 80873023
4-(2-methylcyclohexyl)oxy-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80845160
3-[(4-amino-6-morpholin-4-yl-1,3,5-triazin-2-yl)sulfanyl]propan-1-ol
CID 80890217
2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80770087
4-cyclohexylsulfanyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80886210
2-N-(2,3-dimethylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80826348
4-morpholin-4-yl-6-propan-2-yl-1,3,5-triazin-2-amine
CID 63868604

Frequently Asked Questions

What is the IUPAC name of 4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (CID 107765184) is 4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is CC1OCCC1Sc1nc(N)nc(N2CCOCC2)n1.
What is the InChIKey of 4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is DLMHNHDFAGUOSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2S/c1-8-9(2-5-19-8)20-12-15-10(13)14-11(16-12)17-3-6-18-7-4-17/h8-9H,2-7H2,1H3,(H2,13,14,15,16).
What are the key properties of 4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 297.38 g/mol, XLogP of 0.56, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methyloxolan-3-yl)sulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 107765184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).