N-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide

C10H19N5O2S — CID 105362429

IUPACN-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide
SMILESCCc1nnc(NCCNS(C)(=O)=O)nc1CC
InChIInChI=1S/C10H19N5O2S/c1-4-8-9(5-2)14-15-10(13-8)11-6-7-12-18(3,16)17/h12H,4-7H2,1-3H3,(H,11,13,15)
InChIKeyTUBZQXVKXGINEV-UHFFFAOYSA-N
MW273.36 g/mol
LogP-0.04
Rot. Bonds7

About N-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide

N-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide (PubChem CID 105362429) has the molecular formula C10H19N5O2S and a molecular weight of 273.36 g/mol. Its IUPAC name is N-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide
PubChem CID105362429
Molecular FormulaC10H19N5O2S
Molecular Weight273.36 g/mol
Exact Mass273.13
IUPAC NameN-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide
SMILESCCc1nnc(NCCNS(C)(=O)=O)nc1CC
InChIInChI=1S/C10H19N5O2S/c1-4-8-9(5-2)14-15-10(13-8)11-6-7-12-18(3,16)17/h12H,4-7H2,1-3H3,(H,11,13,15)
InChIKeyTUBZQXVKXGINEV-UHFFFAOYSA-N
XLogP-0.04
TPSA96.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide with MolForge

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Related Compounds

N-(2-chloroethyl)-5,6-diethyl-1,2,4-triazin-3-amine
CID 105363386
N-[3-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propyl]-N-ethylmethanesulfonamide
CID 105362475
N'-(5,6-diethyl-1,2,4-triazin-3-yl)butane-1,4-diamine
CID 105362304
5,6-diethyl-N-(2-methylsulfanylethyl)-1,2,4-triazin-3-amine
CID 105362652
3-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propanamide
CID 105362431
N-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 105362365
N-[2-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]ethyl]methanesulfonamide
CID 62870440
N-but-3-ynyl-5,6-diethyl-1,2,4-triazin-3-amine
CID 105362658
1-N-(5,6-diethyl-1,2,4-triazin-3-yl)butane-1,3-diamine
CID 105362989
2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide
CID 105362361
6-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]hexanoic acid
CID 105362032
N-(5,6-diethyl-1,2,4-triazin-3-yl)-2-(methylamino)ethanesulfonamide
CID 114388302

Frequently Asked Questions

What is the IUPAC name of N-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide?
The IUPAC name of N-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide (CID 105362429) is N-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide.
What is the SMILES notation for N-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide?
The canonical SMILES for N-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide is CCc1nnc(NCCNS(C)(=O)=O)nc1CC.
What is the InChIKey of N-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide?
The InChIKey is TUBZQXVKXGINEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O2S/c1-4-8-9(5-2)14-15-10(13-8)11-6-7-12-18(3,16)17/h12H,4-7H2,1-3H3,(H,11,13,15).
What are the key properties of N-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide?
N-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide has a molecular weight of 273.36 g/mol, XLogP of -0.04, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]methanesulfonamide is sourced from PubChem (CID 105362429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).