N-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide

C11H19NO2S — CID 103765738

IUPACN-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)NC1C2C3CCC(C3)C12
InChIInChI=1S/C11H19NO2S/c1-6(2)15(13,14)12-11-9-7-3-4-8(5-7)10(9)11/h6-12H,3-5H2,1-2H3
InChIKeyFCILEHUCXKIRHE-UHFFFAOYSA-N
MW229.34 g/mol
LogP1.36
Rot. Bonds3

About N-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide

N-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide (PubChem CID 103765738) has the molecular formula C11H19NO2S and a molecular weight of 229.34 g/mol. Its IUPAC name is N-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide.

Molecular Properties

Compound NameN-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide
PubChem CID103765738
Molecular FormulaC11H19NO2S
Molecular Weight229.34 g/mol
Exact Mass229.11
IUPAC NameN-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)NC1C2C3CCC(C3)C12
InChIInChI=1S/C11H19NO2S/c1-6(2)15(13,14)12-11-9-7-3-4-8(5-7)10(9)11/h6-12H,3-5H2,1-2H3
InChIKeyFCILEHUCXKIRHE-UHFFFAOYSA-N
XLogP1.36
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.34
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-bicyclo[3.1.0]hexanyl)propane-2-sulfonamide
CID 130974894
N-(2-cyclopropylcyclopropyl)propane-2-sulfonamide
CID 168726732
N-cyclodecylpropane-2-sulfonamide
CID 131977128
N-(7-oxabicyclo[2.2.1]heptan-2-yl)propane-2-sulfonamide
CID 80601899
N-(3,4-dimethylcyclohexyl)propane-2-sulfonamide
CID 64749002
(2S)-2-amino-3-methyl-N-(3-tricyclo[3.2.1.02,4]octanyl)butanamide
CID 103798202
N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)propane-2-sulfonamide
CID 66211739
2-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)propanamide
CID 103767079
N-(2-hydroxycyclobutyl)propane-2-sulfonamide
CID 168726677
2-[methyl(3-tricyclo[3.2.1.02,4]octanylcarbamoyl)amino]propanoic acid
CID 114096749
2-propan-2-yloxy-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide
CID 103767092
tert-butyl 2-(3-tricyclo[3.2.1.02,4]octanylamino)propanoate
CID 114095991

Frequently Asked Questions

What is the IUPAC name of N-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide?
The IUPAC name of N-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide (CID 103765738) is N-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide.
What is the SMILES notation for N-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide?
The canonical SMILES for N-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide is CC(C)S(=O)(=O)NC1C2C3CCC(C3)C12.
What is the InChIKey of N-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide?
The InChIKey is FCILEHUCXKIRHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2S/c1-6(2)15(13,14)12-11-9-7-3-4-8(5-7)10(9)11/h6-12H,3-5H2,1-2H3.
What are the key properties of N-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide?
N-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide has a molecular weight of 229.34 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-tricyclo[3.2.1.02,4]octanyl)propane-2-sulfonamide is sourced from PubChem (CID 103765738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).