N-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide

C8H16N2O2S — CID 165469234

IUPACN-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide
SMILESCS(=O)(=O)NC1CC2CNC(C2)C1
InChIInChI=1S/C8H16N2O2S/c1-13(11,12)10-8-3-6-2-7(4-8)9-5-6/h6-10H,2-5H2,1H3
InChIKeyBGCBDEZFYOZSPA-UHFFFAOYSA-N
MW204.29 g/mol
LogP-0.32
Rot. Bonds2

About N-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide

N-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide (PubChem CID 165469234) has the molecular formula C8H16N2O2S and a molecular weight of 204.29 g/mol. Its IUPAC name is N-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide
PubChem CID165469234
Molecular FormulaC8H16N2O2S
Molecular Weight204.29 g/mol
Exact Mass204.09
IUPAC NameN-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide
SMILESCS(=O)(=O)NC1CC2CNC(C2)C1
InChIInChI=1S/C8H16N2O2S/c1-13(11,12)10-8-3-6-2-7(4-8)9-5-6/h6-10H,2-5H2,1H3
InChIKeyBGCBDEZFYOZSPA-UHFFFAOYSA-N
XLogP-0.32
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.29
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide?
The IUPAC name of N-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide (CID 165469234) is N-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide.
What is the SMILES notation for N-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide?
The canonical SMILES for N-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide is CS(=O)(=O)NC1CC2CNC(C2)C1.
What is the InChIKey of N-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide?
The InChIKey is BGCBDEZFYOZSPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2S/c1-13(11,12)10-8-3-6-2-7(4-8)9-5-6/h6-10H,2-5H2,1H3.
What are the key properties of N-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide?
N-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide has a molecular weight of 204.29 g/mol, XLogP of -0.32, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-azabicyclo[3.2.1]octan-3-yl)methanesulfonamide is sourced from PubChem (CID 165469234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).