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

C7H18N2O2S — CID 43272093

IUPAC2-amino-N-methyl-N-(2-methylpropyl)ethanesulfonamide
SMILESCC(C)CN(C)S(=O)(=O)CCN
InChIInChI=1S/C7H18N2O2S/c1-7(2)6-9(3)12(10,11)5-4-8/h7H,4-6,8H2,1-3H3
InChIKeyRWYXDTKLMSHLKD-UHFFFAOYSA-N
MW194.30 g/mol
LogP-0.14
Rot. Bonds5

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

2-amino-N-methyl-N-(2-methylpropyl)ethanesulfonamide (PubChem CID 43272093) has the molecular formula C7H18N2O2S and a molecular weight of 194.30 g/mol. Its IUPAC name is 2-amino-N-methyl-N-(2-methylpropyl)ethanesulfonamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-(2-methylpropyl)ethanesulfonamide
PubChem CID43272093
Molecular FormulaC7H18N2O2S
Molecular Weight194.30 g/mol
Exact Mass194.11
IUPAC Name2-amino-N-methyl-N-(2-methylpropyl)ethanesulfonamide
SMILESCC(C)CN(C)S(=O)(=O)CCN
InChIInChI=1S/C7H18N2O2S/c1-7(2)6-9(3)12(10,11)5-4-8/h7H,4-6,8H2,1-3H3
InChIKeyRWYXDTKLMSHLKD-UHFFFAOYSA-N
XLogP-0.14
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.30
LogP ≤ 5-0.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-(2-methylpropyl)ethanesulfonamide?
The IUPAC name of 2-amino-N-methyl-N-(2-methylpropyl)ethanesulfonamide (CID 43272093) is 2-amino-N-methyl-N-(2-methylpropyl)ethanesulfonamide.
What is the SMILES notation for 2-amino-N-methyl-N-(2-methylpropyl)ethanesulfonamide?
The canonical SMILES for 2-amino-N-methyl-N-(2-methylpropyl)ethanesulfonamide is CC(C)CN(C)S(=O)(=O)CCN.
What is the InChIKey of 2-amino-N-methyl-N-(2-methylpropyl)ethanesulfonamide?
The InChIKey is RWYXDTKLMSHLKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O2S/c1-7(2)6-9(3)12(10,11)5-4-8/h7H,4-6,8H2,1-3H3.
What are the key properties of 2-amino-N-methyl-N-(2-methylpropyl)ethanesulfonamide?
2-amino-N-methyl-N-(2-methylpropyl)ethanesulfonamide has a molecular weight of 194.30 g/mol, XLogP of -0.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-(2-methylpropyl)ethanesulfonamide is sourced from PubChem (CID 43272093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).