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

C13H22N4S — CID 80835884

IUPAC4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine
SMILESCCCNc1nc(C)cc(N2CCSCC2C)n1
InChIInChI=1S/C13H22N4S/c1-4-5-14-13-15-10(2)8-12(16-13)17-6-7-18-9-11(17)3/h8,11H,4-7,9H2,1-3H3,(H,14,15,16)
InChIKeyZCNSFXPQVYWQFG-UHFFFAOYSA-N
MW266.41 g/mol
LogP2.55
Rot. Bonds4

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

4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine (PubChem CID 80835884) has the molecular formula C13H22N4S and a molecular weight of 266.41 g/mol. Its IUPAC name is 4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine
PubChem CID80835884
Molecular FormulaC13H22N4S
Molecular Weight266.41 g/mol
Exact Mass266.16
IUPAC Name4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine
SMILESCCCNc1nc(C)cc(N2CCSCC2C)n1
InChIInChI=1S/C13H22N4S/c1-4-5-14-13-15-10(2)8-12(16-13)17-6-7-18-9-11(17)3/h8,11H,4-7,9H2,1-3H3,(H,14,15,16)
InChIKeyZCNSFXPQVYWQFG-UHFFFAOYSA-N
XLogP2.55
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-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

5-methyl-4-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine
CID 80835791
4-N,4-N-dimethyl-6-(3-methylthiomorpholin-4-yl)-2-N-propyl-1,3,5-triazine-2,4-diamine
CID 80835693
N-ethyl-2-methyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine
CID 80836054
4-(3,5-dimethylpiperidin-1-yl)-6-methyl-N-propylpyrimidin-2-amine
CID 80766891
2,5-dimethyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-4-amine
CID 80836387
4-methyl-N-propyl-6-(2-propylpiperidin-1-yl)pyrimidin-2-amine
CID 83056953
4-methyl-6-piperazin-1-yl-N-propylpyrimidin-2-amine
CID 80837570
4-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-N-propylpyrimidin-2-amine
CID 80756884
4-(3-ethylsulfonylthiomorpholin-4-yl)-N,6-dimethylpyrimidin-2-amine
CID 80851203
4-(2-azabicyclo[2.2.1]heptan-2-yl)-6-methyl-N-propylpyrimidin-2-amine
CID 80805119
4-(2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl)-6-methyl-N-propylpyrimidin-2-amine
CID 80791554
1-[6-methyl-2-(propylamino)pyrimidin-4-yl]pyrrolidine-2-carboxamide
CID 80765391

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine?
The IUPAC name of 4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine (CID 80835884) is 4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine.
What is the SMILES notation for 4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine?
The canonical SMILES for 4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine is CCCNc1nc(C)cc(N2CCSCC2C)n1.
What is the InChIKey of 4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine?
The InChIKey is ZCNSFXPQVYWQFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4S/c1-4-5-14-13-15-10(2)8-12(16-13)17-6-7-18-9-11(17)3/h8,11H,4-7,9H2,1-3H3,(H,14,15,16).
What are the key properties of 4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine?
4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine has a molecular weight of 266.41 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-2-amine is sourced from PubChem (CID 80835884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).