4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine

C9H10N4OS — CID 78909370

IUPAC4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine
SMILESCSc1nc(N)nc(-c2ccc(C)o2)n1
InChIInChI=1S/C9H10N4OS/c1-5-3-4-6(14-5)7-11-8(10)13-9(12-7)15-2/h3-4H,1-2H3,(H2,10,11,12,13)
InChIKeySFQKULDIARINOL-UHFFFAOYSA-N
MW222.27 g/mol
LogP1.74
Rot. Bonds2

About 4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine

4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine (PubChem CID 78909370) has the molecular formula C9H10N4OS and a molecular weight of 222.27 g/mol. Its IUPAC name is 4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine
PubChem CID78909370
Molecular FormulaC9H10N4OS
Molecular Weight222.27 g/mol
Exact Mass222.06
IUPAC Name4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine
SMILESCSc1nc(N)nc(-c2ccc(C)o2)n1
InChIInChI=1S/C9H10N4OS/c1-5-3-4-6(14-5)7-11-8(10)13-9(12-7)15-2/h3-4H,1-2H3,(H2,10,11,12,13)
InChIKeySFQKULDIARINOL-UHFFFAOYSA-N
XLogP1.74
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.27
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(1-benzofuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine
CID 78909353
4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine
CID 83084815
2-(4-amino-6-methylsulfanyl-1,3,5-triazin-2-yl)-3-fluorophenol
CID 136678060
4-methylsulfanyl-6-pyridazin-4-yl-1,3,5-triazin-2-amine
CID 104670074
5-bromo-4,6-dichloro-2-(5-methylfuran-2-yl)pyrimidine
CID 66313382
4-(2-fluoro-4-methoxyphenyl)-6-methylsulfanyl-1,3,5-triazin-2-amine
CID 102882416
4-(5-bromo-4-methylthiophen-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine
CID 83084820
4-(3-chloro-4-fluorophenyl)-6-methylsulfanyl-1,3,5-triazin-2-amine
CID 83083653
4-(2-methylquinolin-4-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine
CID 83084220
4-methylsulfanyl-6-quinoxalin-6-yl-1,3,5-triazin-2-amine
CID 83084099
4-methylsulfanyl-6-(thiadiazol-4-yl)-1,3,5-triazin-2-amine
CID 83084460
4-(4-bromo-2,6-difluorophenyl)-6-methylsulfanyl-1,3,5-triazin-2-amine
CID 83085029

Frequently Asked Questions

What is the IUPAC name of 4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine (CID 78909370) is 4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine is CSc1nc(N)nc(-c2ccc(C)o2)n1.
What is the InChIKey of 4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine?
The InChIKey is SFQKULDIARINOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4OS/c1-5-3-4-6(14-5)7-11-8(10)13-9(12-7)15-2/h3-4H,1-2H3,(H2,10,11,12,13).
What are the key properties of 4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine?
4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine has a molecular weight of 222.27 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methylfuran-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 78909370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).