2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide

C10H20N2O2S — CID 63681923

IUPAC2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide
SMILESNCCS(=O)(=O)NCC1CC2CCC1C2
InChIInChI=1S/C10H20N2O2S/c11-3-4-15(13,14)12-7-10-6-8-1-2-9(10)5-8/h8-10,12H,1-7,11H2
InChIKeyKTWXVFOMAXCUCB-UHFFFAOYSA-N
MW232.35 g/mol
LogP0.30
Rot. Bonds5

About 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide

2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide (PubChem CID 63681923) has the molecular formula C10H20N2O2S and a molecular weight of 232.35 g/mol. Its IUPAC name is 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide.

Molecular Properties

Compound Name2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide
PubChem CID63681923
Molecular FormulaC10H20N2O2S
Molecular Weight232.35 g/mol
Exact Mass232.12
IUPAC Name2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide
SMILESNCCS(=O)(=O)NCC1CC2CCC1C2
InChIInChI=1S/C10H20N2O2S/c11-3-4-15(13,14)12-7-10-6-8-1-2-9(10)5-8/h8-10,12H,1-7,11H2
InChIKeyKTWXVFOMAXCUCB-UHFFFAOYSA-N
XLogP0.30
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bicyclo[2.2.1]heptanylmethyl)-4-(ethylamino)butane-1-sulfonamide
CID 106064039
4-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-2,5-dimethylfuran-3-sulfonamide
CID 106064030
5-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-1H-pyrazole-4-sulfonamide
CID 63689393
5-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-fluorobenzenesulfonamide
CID 106064052
N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methylsulfonylethanamine
CID 63683685
4-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)thiophene-2-sulfonamide
CID 106064093
N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(2-cyanophenyl)methanesulfonamide
CID 63683358
1-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)cyclopropane-1-carboxamide
CID 80599268
4-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-3-methoxybenzenesulfonamide
CID 81441291
N-[[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]methyl]-4-nitrobenzenesulfonamide
CID 7064921
N-(2-bicyclo[2.2.1]heptanylmethyl)-2-(methylamino)pyrimidine-5-sulfonamide
CID 63684841
N-(2-bicyclo[2.2.1]heptanylmethyl)-4-nitrobenzenesulfonamide
CID 4003655

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide?
The IUPAC name of 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide (CID 63681923) is 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide.
What is the SMILES notation for 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide?
The canonical SMILES for 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide is NCCS(=O)(=O)NCC1CC2CCC1C2.
What is the InChIKey of 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide?
The InChIKey is KTWXVFOMAXCUCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2S/c11-3-4-15(13,14)12-7-10-6-8-1-2-9(10)5-8/h8-10,12H,1-7,11H2.
What are the key properties of 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide?
2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide has a molecular weight of 232.35 g/mol, XLogP of 0.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)ethanesulfonamide is sourced from PubChem (CID 63681923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).