6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine

C10H21N7O2S — CID 80929618

IUPAC6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine
SMILESCN(C)c1nc(NN)nc(NCC(C)(C)S(C)(=O)=O)n1
InChIInChI=1S/C10H21N7O2S/c1-10(2,20(5,18)19)6-12-7-13-8(16-11)15-9(14-7)17(3)4/h6,11H2,1-5H3,(H2,12,13,14,15,16)
InChIKeyMONIAUBIZZBBCF-UHFFFAOYSA-N
MW303.39 g/mol
LogP-0.54
Rot. Bonds6

About 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine

6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine (PubChem CID 80929618) has the molecular formula C10H21N7O2S and a molecular weight of 303.39 g/mol. Its IUPAC name is 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine
PubChem CID80929618
Molecular FormulaC10H21N7O2S
Molecular Weight303.39 g/mol
Exact Mass303.15
IUPAC Name6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine
SMILESCN(C)c1nc(NN)nc(NCC(C)(C)S(C)(=O)=O)n1
InChIInChI=1S/C10H21N7O2S/c1-10(2,20(5,18)19)6-12-7-13-8(16-11)15-9(14-7)17(3)4/h6,11H2,1-5H3,(H2,12,13,14,15,16)
InChIKeyMONIAUBIZZBBCF-UHFFFAOYSA-N
XLogP-0.54
TPSA126.13 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.39
LogP ≤ 5-0.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine with MolForge

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Related Compounds

6-chloro-2-N,2-N-dimethyl-4-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine
CID 79557079
1-[[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]amino]-2-methylbutan-2-ol
CID 80915923
2-[[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]amino]acetamide
CID 80932664
6-hydrazinyl-4-N,4-N-dimethyl-2-N-(3-methyl-2-propan-2-ylbutyl)-1,3,5-triazine-2,4-diamine
CID 102909000
ethyl 4-[[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]amino]butanoate
CID 80915400
2-N-[2-(diethylamino)ethyl]-6-hydrazinyl-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80931722
6-hydrazinyl-4-N,4-N-dimethyl-2-N-[3-[methyl(propan-2-yl)amino]propyl]-1,3,5-triazine-2,4-diamine
CID 106043693
6-hydrazinyl-4-N,4-N-dimethyl-2-N-(3-propoxypropyl)-1,3,5-triazine-2,4-diamine
CID 82946845
3-[[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]amino]propane-1,2-diol
CID 80921975
3-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2,2-dimethylpropanamide
CID 106280499
6-methoxy-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine
CID 80849425
1-[[[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol
CID 80915853

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine (CID 80929618) is 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine is CN(C)c1nc(NN)nc(NCC(C)(C)S(C)(=O)=O)n1.
What is the InChIKey of 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is MONIAUBIZZBBCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N7O2S/c1-10(2,20(5,18)19)6-12-7-13-8(16-11)15-9(14-7)17(3)4/h6,11H2,1-5H3,(H2,12,13,14,15,16).
What are the key properties of 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine?
6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 303.39 g/mol, XLogP of -0.54, 6 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(2-methyl-2-methylsulfonylpropyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80929618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).