(5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide

C10H20N2O2S — CID 137402525

IUPAC(5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide
SMILESCC(C)N1C2CC[C@H]1CC(S(N)(=O)=O)C2
InChIInChI=1S/C10H20N2O2S/c1-7(2)12-8-3-4-9(12)6-10(5-8)15(11,13)14/h7-10H,3-6H2,1-2H3,(H2,11,13,14)/t8-,9?,10?/m0/s1
InChIKeyUZWSDMWKCSPFOX-IDKOKCKLSA-N
MW232.35 g/mol
LogP0.68
Rot. Bonds2

About (5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide

(5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide (PubChem CID 137402525) has the molecular formula C10H20N2O2S and a molecular weight of 232.35 g/mol. Its IUPAC name is (5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide.

Molecular Properties

Compound Name(5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide
PubChem CID137402525
Molecular FormulaC10H20N2O2S
Molecular Weight232.35 g/mol
Exact Mass232.12
IUPAC Name(5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide
SMILESCC(C)N1C2CC[C@H]1CC(S(N)(=O)=O)C2
InChIInChI=1S/C10H20N2O2S/c1-7(2)12-8-3-4-9(12)6-10(5-8)15(11,13)14/h7-10H,3-6H2,1-2H3,(H2,11,13,14)/t8-,9?,10?/m0/s1
InChIKeyUZWSDMWKCSPFOX-IDKOKCKLSA-N
XLogP0.68
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide 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 (5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide?
The IUPAC name of (5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide (CID 137402525) is (5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide.
What is the SMILES notation for (5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide?
The canonical SMILES for (5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide is CC(C)N1C2CC[C@H]1CC(S(N)(=O)=O)C2.
What is the InChIKey of (5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide?
The InChIKey is UZWSDMWKCSPFOX-IDKOKCKLSA-N. The full InChI is InChI=1S/C10H20N2O2S/c1-7(2)12-8-3-4-9(12)6-10(5-8)15(11,13)14/h7-10H,3-6H2,1-2H3,(H2,11,13,14)/t8-,9?,10?/m0/s1.
What are the key properties of (5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide?
(5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide has a molecular weight of 232.35 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-8-propan-2-yl-8-azabicyclo[3.2.1]octane-3-sulfonamide is sourced from PubChem (CID 137402525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).