N-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

C9H15N5OS — CID 976523

IUPACN-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCNc1nc(SC)nc(N2CCOCC2)n1
InChIInChI=1S/C9H15N5OS/c1-10-7-11-8(13-9(12-7)16-2)14-3-5-15-6-4-14/h3-6H2,1-2H3,(H,10,11,12,13)
InChIKeyBUMLYLLSCIVBEZ-UHFFFAOYSA-N
MW241.32 g/mol
LogP0.47
Rot. Bonds3

About N-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

N-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 976523) has the molecular formula C9H15N5OS and a molecular weight of 241.32 g/mol. Its IUPAC name is N-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID976523
Molecular FormulaC9H15N5OS
Molecular Weight241.32 g/mol
Exact Mass241.10
IUPAC NameN-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCNc1nc(SC)nc(N2CCOCC2)n1
InChIInChI=1S/C9H15N5OS/c1-10-7-11-8(13-9(12-7)16-2)14-3-5-15-6-4-14/h3-6H2,1-2H3,(H,10,11,12,13)
InChIKeyBUMLYLLSCIVBEZ-UHFFFAOYSA-N
XLogP0.47
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

(4-Dimethylamino-6-morpholin-4-yl-[1,3,5]triazin-2-ylsulfanyl)-acetonitrile
CID 2204629
4-Methoxy-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
CID 709353
(4-Methylamino-6-morpholin-4-yl-[1,3,5]triazin-2-ylsulfanyl)-acetic acid methyl ester
CID 654176
N-isopropyl-4-(methylthio)-6-(4-morpholinyl)-1,3,5-triazin-2-amine
CID 898987
N-isobutyl-4-(methylthio)-6-(4-morpholinyl)-1,3,5-triazin-2-amine
CID 935626
4-methoxy-N-methyl-6-(4-morpholinyl)-1,3,5-triazin-2-amine
CID 976569
(4-Ethylamino-6-morpholin-4-yl-[1,3,5]triazin-2-ylsulfanyl)-acetic acid methyl ester
CID 650609
s-Triazine, 2,4-bis(methylamino)-6-morpholino-
CID 204412
N-(tert-butyl)-4-(methylthio)-6-(4-morpholinyl)-1,3,5-triazin-2-amine
CID 977239
4-Methylsulfanyl-6-(2-morpholin-4-ylethylsulfanyl)-1,3,5-triazin-2-amine
CID 44323467
s-Triazine, 2,4-bis(methylamino)-6-morpholino-, hydrochloride
CID 204413
4-(Methylthio)-6-morpholino-1,3,5-triazin-2-amine
CID 2726604

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of N-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (CID 976523) is N-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for N-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for N-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is CNc1nc(SC)nc(N2CCOCC2)n1.
What is the InChIKey of N-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is BUMLYLLSCIVBEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5OS/c1-10-7-11-8(13-9(12-7)16-2)14-3-5-15-6-4-14/h3-6H2,1-2H3,(H,10,11,12,13).
What are the key properties of N-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
N-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 241.32 g/mol, XLogP of 0.47, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-methylsulfanyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 976523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).