N-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine

C11H18N4S2 — CID 80835888

IUPACN-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine
SMILESCNc1cc(N2CCSCC2C)nc(SC)n1
InChIInChI=1S/C11H18N4S2/c1-8-7-17-5-4-15(8)10-6-9(12-2)13-11(14-10)16-3/h6,8H,4-5,7H2,1-3H3,(H,12,13,14)
InChIKeyQOPTVETWZZXEEY-UHFFFAOYSA-N
MW270.43 g/mol
LogP2.18
Rot. Bonds3

About N-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine

N-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine (PubChem CID 80835888) has the molecular formula C11H18N4S2 and a molecular weight of 270.43 g/mol. Its IUPAC name is N-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine
PubChem CID80835888
Molecular FormulaC11H18N4S2
Molecular Weight270.43 g/mol
Exact Mass270.10
IUPAC NameN-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine
SMILESCNc1cc(N2CCSCC2C)nc(SC)n1
InChIInChI=1S/C11H18N4S2/c1-8-7-17-5-4-15(8)10-6-9(12-2)13-11(14-10)16-3/h6,8H,4-5,7H2,1-3H3,(H,12,13,14)
InChIKeyQOPTVETWZZXEEY-UHFFFAOYSA-N
XLogP2.18
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.43
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(3-ethylsulfonylthiomorpholin-4-yl)-N-methyl-2-methylsulfanylpyrimidin-4-amine
CID 80833716
N-methyl-2-methylsulfanyl-6-(1,4-thiazepan-4-yl)pyrimidin-4-amine
CID 80796529
N-ethyl-2-methyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine
CID 80836054
[6-(2-methylpyrrolidin-1-yl)-2-methylsulfanylpyrimidin-4-yl]hydrazine
CID 80898992
6-(3,4-dimethylpiperazin-1-yl)-N-methyl-2-methylsulfanylpyrimidin-4-amine
CID 80834108
6-(2-cyclopentylpyrrolidin-1-yl)-N-methyl-2-methylsulfanylpyrimidin-4-amine
CID 80819682
6-(2,4-dimethylpiperidin-1-yl)-N-ethyl-2-methylsulfanylpyrimidin-4-amine
CID 80826076
ethane;N-methyl-2-methylsulfanyl-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 90766757
1-[6-(methylamino)-2-methylsulfanylpyrimidin-4-yl]piperidin-4-ol
CID 80763962
(2-methylsulfanyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine
CID 80932159
2-methyl-6-(3-methylthiomorpholin-4-yl)pyridine-4-carbonitrile
CID 114766322
N-methyl-1-[6-(3-methylthiomorpholin-4-yl)pyrazin-2-yl]methanamine
CID 66450723

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine?
The IUPAC name of N-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine (CID 80835888) is N-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine.
What is the SMILES notation for N-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine?
The canonical SMILES for N-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine is CNc1cc(N2CCSCC2C)nc(SC)n1.
What is the InChIKey of N-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine?
The InChIKey is QOPTVETWZZXEEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4S2/c1-8-7-17-5-4-15(8)10-6-9(12-2)13-11(14-10)16-3/h6,8H,4-5,7H2,1-3H3,(H,12,13,14).
What are the key properties of N-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine?
N-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine has a molecular weight of 270.43 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-methylsulfanyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine is sourced from PubChem (CID 80835888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).