4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine

C11H21N7O2S — CID 80929641

IUPAC4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
SMILESCN(CCS(C)(=O)=O)c1nc(NN)nc(N2CCCC2)n1
InChIInChI=1S/C11H21N7O2S/c1-17(7-8-21(2,19)20)10-13-9(16-12)14-11(15-10)18-5-3-4-6-18/h3-8,12H2,1-2H3,(H,13,14,15,16)
InChIKeyYEEGGPQNZNOXDG-UHFFFAOYSA-N
MW315.40 g/mol
LogP-0.76
Rot. Bonds6

About 4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine

4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine (PubChem CID 80929641) has the molecular formula C11H21N7O2S and a molecular weight of 315.40 g/mol. Its IUPAC name is 4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
PubChem CID80929641
Molecular FormulaC11H21N7O2S
Molecular Weight315.40 g/mol
Exact Mass315.15
IUPAC Name4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
SMILESCN(CCS(C)(=O)=O)c1nc(NN)nc(N2CCCC2)n1
InChIInChI=1S/C11H21N7O2S/c1-17(7-8-21(2,19)20)10-13-9(16-12)14-11(15-10)18-5-3-4-6-18/h3-8,12H2,1-2H3,(H,13,14,15,16)
InChIKeyYEEGGPQNZNOXDG-UHFFFAOYSA-N
XLogP-0.76
TPSA117.34 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.40
LogP ≤ 5-0.76
H-Bond Donors ≤ 52
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 4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine with MolForge

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Related Compounds

N-(cyclopropylmethyl)-4-hydrazinyl-N-methyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80899275
4-N-butyl-2-N,4-N-dimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80753745
N-butyl-4-hydrazinyl-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80916546
N-ethyl-4-hydrazinyl-6-piperidin-1-yl-N-propan-2-yl-1,3,5-triazin-2-amine
CID 80944115
2-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80791674
4-hydrazinyl-N-(2-methylsulfonylethyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80898859
3-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]propane-1-sulfonamide
CID 80900517
4-N-(2-ethoxyethyl)-2-N,4-N-dimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
CID 81064691
2-hydrazinyl-N,6-dimethyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine
CID 80928821
4-N-(2,2-dimethylpropyl)-2-N,4-N-dimethyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80819118
N-(cyclobutylmethyl)-4-hydrazinyl-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80905403
1-[4-[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]-1,4-diazepan-1-yl]ethanone
CID 80901624

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine (CID 80929641) is 4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine is CN(CCS(C)(=O)=O)c1nc(NN)nc(N2CCCC2)n1.
What is the InChIKey of 4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine?
The InChIKey is YEEGGPQNZNOXDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N7O2S/c1-17(7-8-21(2,19)20)10-13-9(16-12)14-11(15-10)18-5-3-4-6-18/h3-8,12H2,1-2H3,(H,13,14,15,16).
What are the key properties of 4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine?
4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine has a molecular weight of 315.40 g/mol, XLogP of -0.76, 6 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80929641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).