N-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide

C8H18N2O2S — CID 63764902

IUPACN-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)NCC(N)C1CC1
InChIInChI=1S/C8H18N2O2S/c1-6(2)13(11,12)10-5-8(9)7-3-4-7/h6-8,10H,3-5,9H2,1-2H3
InChIKeyLOOLUDPZHVVUIY-UHFFFAOYSA-N
MW206.31 g/mol
LogP0.05
Rot. Bonds5

About N-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide

N-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide (PubChem CID 63764902) has the molecular formula C8H18N2O2S and a molecular weight of 206.31 g/mol. Its IUPAC name is N-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide.

Molecular Properties

Compound NameN-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide
PubChem CID63764902
Molecular FormulaC8H18N2O2S
Molecular Weight206.31 g/mol
Exact Mass206.11
IUPAC NameN-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)NCC(N)C1CC1
InChIInChI=1S/C8H18N2O2S/c1-6(2)13(11,12)10-5-8(9)7-3-4-7/h6-8,10H,3-5,9H2,1-2H3
InChIKeyLOOLUDPZHVVUIY-UHFFFAOYSA-N
XLogP0.05
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide?
The IUPAC name of N-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide (CID 63764902) is N-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide.
What is the SMILES notation for N-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide?
The canonical SMILES for N-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide is CC(C)S(=O)(=O)NCC(N)C1CC1.
What is the InChIKey of N-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide?
The InChIKey is LOOLUDPZHVVUIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2S/c1-6(2)13(11,12)10-5-8(9)7-3-4-7/h6-8,10H,3-5,9H2,1-2H3.
What are the key properties of N-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide?
N-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide has a molecular weight of 206.31 g/mol, XLogP of 0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide is sourced from PubChem (CID 63764902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).