2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide

C8H20N2O2S — CID 43273757

IUPAC2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide
SMILESCCN(CC(C)C)S(=O)(=O)CCN
InChIInChI=1S/C8H20N2O2S/c1-4-10(7-8(2)3)13(11,12)6-5-9/h8H,4-7,9H2,1-3H3
InChIKeyLUYHYJXDVGOPSU-UHFFFAOYSA-N
MW208.33 g/mol
LogP0.25
Rot. Bonds6

About 2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide

2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide (PubChem CID 43273757) has the molecular formula C8H20N2O2S and a molecular weight of 208.33 g/mol. Its IUPAC name is 2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide.

Molecular Properties

Compound Name2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide
PubChem CID43273757
Molecular FormulaC8H20N2O2S
Molecular Weight208.33 g/mol
Exact Mass208.12
IUPAC Name2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide
SMILESCCN(CC(C)C)S(=O)(=O)CCN
InChIInChI=1S/C8H20N2O2S/c1-4-10(7-8(2)3)13(11,12)6-5-9/h8H,4-7,9H2,1-3H3
InChIKeyLUYHYJXDVGOPSU-UHFFFAOYSA-N
XLogP0.25
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.33
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide?
The IUPAC name of 2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide (CID 43273757) is 2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide.
What is the SMILES notation for 2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide?
The canonical SMILES for 2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide is CCN(CC(C)C)S(=O)(=O)CCN.
What is the InChIKey of 2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide?
The InChIKey is LUYHYJXDVGOPSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O2S/c1-4-10(7-8(2)3)13(11,12)6-5-9/h8H,4-7,9H2,1-3H3.
What are the key properties of 2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide?
2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide has a molecular weight of 208.33 g/mol, XLogP of 0.25, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide is sourced from PubChem (CID 43273757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).