2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide

C10H16N6O2S — CID 971565

IUPAC2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide
SMILESCNc1nc(SCC(N)=O)nc(N2CCOCC2)n1
InChIInChI=1S/C10H16N6O2S/c1-12-8-13-9(16-2-4-18-5-3-16)15-10(14-8)19-6-7(11)17/h2-6H2,1H3,(H2,11,17)(H,12,13,14,15)
InChIKeyUEQNUHKGNQCMGO-UHFFFAOYSA-N
MW284.35 g/mol
LogP-0.67
Rot. Bonds5

About 2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide

2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide (PubChem CID 971565) has the molecular formula C10H16N6O2S and a molecular weight of 284.35 g/mol. Its IUPAC name is 2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide.

Molecular Properties

Compound Name2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide
PubChem CID971565
Molecular FormulaC10H16N6O2S
Molecular Weight284.35 g/mol
Exact Mass284.11
IUPAC Name2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide
SMILESCNc1nc(SCC(N)=O)nc(N2CCOCC2)n1
InChIInChI=1S/C10H16N6O2S/c1-12-8-13-9(16-2-4-18-5-3-16)15-10(14-8)19-6-7(11)17/h2-6H2,1H3,(H2,11,17)(H,12,13,14,15)
InChIKeyUEQNUHKGNQCMGO-UHFFFAOYSA-N
XLogP-0.67
TPSA106.26 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.35
LogP ≤ 5-0.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide?
The IUPAC name of 2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide (CID 971565) is 2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide.
What is the SMILES notation for 2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide?
The canonical SMILES for 2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide is CNc1nc(SCC(N)=O)nc(N2CCOCC2)n1.
What is the InChIKey of 2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide?
The InChIKey is UEQNUHKGNQCMGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N6O2S/c1-12-8-13-9(16-2-4-18-5-3-16)15-10(14-8)19-6-7(11)17/h2-6H2,1H3,(H2,11,17)(H,12,13,14,15).
What are the key properties of 2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide?
2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide has a molecular weight of 284.35 g/mol, XLogP of -0.67, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(methylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]acetamide is sourced from PubChem (CID 971565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).