N-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide

C7H14N2O2S — CID 127362905

IUPACN-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide
SMILESCNS(=O)(=O)N1CC2CCC1C2
InChIInChI=1S/C7H14N2O2S/c1-8-12(10,11)9-5-6-2-3-7(9)4-6/h6-8H,2-5H2,1H3
InChIKeyJXJBOCSGVROLPU-UHFFFAOYSA-N
MW190.27 g/mol
LogP-0.07
Rot. Bonds2

About N-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide

N-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide (PubChem CID 127362905) has the molecular formula C7H14N2O2S and a molecular weight of 190.27 g/mol. Its IUPAC name is N-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide.

Molecular Properties

Compound NameN-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide
PubChem CID127362905
Molecular FormulaC7H14N2O2S
Molecular Weight190.27 g/mol
Exact Mass190.08
IUPAC NameN-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide
SMILESCNS(=O)(=O)N1CC2CCC1C2
InChIInChI=1S/C7H14N2O2S/c1-8-12(10,11)9-5-6-2-3-7(9)4-6/h6-8H,2-5H2,1H3
InChIKeyJXJBOCSGVROLPU-UHFFFAOYSA-N
XLogP-0.07
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.27
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Azabicyclo[2.2.1]heptane-2-sulfonyl chloride
CID 54595104
2-Azabicyclo[2.2.1]heptane-2-sulfonamide
CID 61067967
N-(3-amino-2,2-difluoropropyl)-2-azabicyclo[2.2.1]heptane-2-sulfonamide
CID 120405039
3-Amino-1-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide
CID 177776803
(1R,4R,5R)-5-(aminomethyl)-2-azabicyclo[2.2.1]heptane-2-sulfonamide;hydrochloride
CID 177776938
(1R,4R,5R)-5-(aminomethyl)-2-azabicyclo[2.2.1]heptane-2-sulfonamide
CID 177776939
(4R,5R)-5-(aminomethyl)-2-azabicyclo[2.2.1]heptane-2-sulfonamide;hydrochloride
CID 177777422
N-(3-aminopropyl)-N-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide
CID 61559504
1-(1-Pyrrolidin-1-ylsulfonylpiperidin-3-yl)ethanamine
CID 63854186
[1-(2-Ethylpyrrolidin-1-yl)sulfonylpiperidin-4-yl]methanamine
CID 65772082
[1-(2-Cyclopentylpyrrolidin-1-yl)sulfonylpiperidin-4-yl]methanamine
CID 65789354
[1-(2-Cyclopentylpyrrolidin-1-yl)sulfonylpiperidin-3-yl]methanamine
CID 65789740

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide?
The IUPAC name of N-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide (CID 127362905) is N-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide.
What is the SMILES notation for N-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide?
The canonical SMILES for N-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide is CNS(=O)(=O)N1CC2CCC1C2.
What is the InChIKey of N-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide?
The InChIKey is JXJBOCSGVROLPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2S/c1-8-12(10,11)9-5-6-2-3-7(9)4-6/h6-8H,2-5H2,1H3.
What are the key properties of N-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide?
N-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide has a molecular weight of 190.27 g/mol, XLogP of -0.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-azabicyclo[2.2.1]heptane-2-sulfonamide is sourced from PubChem (CID 127362905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).