2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine

C9H15N3O2S — CID 94063709

IUPAC2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine
SMILESC[C@@H](NS(=O)(=O)N(C)C)c1ccccn1
InChIInChI=1S/C9H15N3O2S/c1-8(9-6-4-5-7-10-9)11-15(13,14)12(2)3/h4-8,11H,1-3H3/t8-/m1/s1
InChIKeyXCBRPTTWCXFETC-MRVPVSSYSA-N
MW229.31 g/mol
LogP0.54
Rot. Bonds4

About 2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine

2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine (PubChem CID 94063709) has the molecular formula C9H15N3O2S and a molecular weight of 229.31 g/mol. Its IUPAC name is 2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine.

Molecular Properties

Compound Name2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine
PubChem CID94063709
Molecular FormulaC9H15N3O2S
Molecular Weight229.31 g/mol
Exact Mass229.09
IUPAC Name2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine
SMILESC[C@@H](NS(=O)(=O)N(C)C)c1ccccn1
InChIInChI=1S/C9H15N3O2S/c1-8(9-6-4-5-7-10-9)11-15(13,14)12(2)3/h4-8,11H,1-3H3/t8-/m1/s1
InChIKeyXCBRPTTWCXFETC-MRVPVSSYSA-N
XLogP0.54
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.31
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-pyridin-2-ylethyl)methanesulfonamide
CID 60681407
2-[1-[[3-aminopropyl(methyl)sulfamoyl]amino]ethyl]pyridine
CID 54952613
N-[(1S)-1-pyridin-2-ylethyl]propane-1-sulfonamide
CID 78980226
4-methyl-N-[(1R)-1-pyridin-2-ylethyl]benzenesulfonamide
CID 40664770
2-bromo-N-(1-pyridin-2-ylethyl)benzenesulfonamide
CID 46799998
3-chloro-2-methyl-N-(1-pyridin-2-ylethyl)propane-1-sulfonamide
CID 79580360
3,5-difluoro-N-[(1S)-1-pyridin-2-ylethyl]benzenesulfonamide
CID 41084343
5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide
CID 17410002
N-[(1S)-1-pyridin-2-ylethyl]naphthalene-2-sulfonamide
CID 2459314
2-cyano-N-[(1S)-1-pyridin-2-ylethyl]benzenesulfonamide
CID 40973699
3-fluoro-N-(1-pyridin-2-ylethyl)benzenesulfonamide
CID 18086450
1-(4-chlorophenyl)-N-[(1S)-1-pyridin-2-ylethyl]methanesulfonamide
CID 95968872

Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine?
The IUPAC name of 2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine (CID 94063709) is 2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine.
What is the SMILES notation for 2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine?
The canonical SMILES for 2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine is C[C@@H](NS(=O)(=O)N(C)C)c1ccccn1.
What is the InChIKey of 2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine?
The InChIKey is XCBRPTTWCXFETC-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H15N3O2S/c1-8(9-6-4-5-7-10-9)11-15(13,14)12(2)3/h4-8,11H,1-3H3/t8-/m1/s1.
What are the key properties of 2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine?
2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine has a molecular weight of 229.31 g/mol, XLogP of 0.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-1-(dimethylsulfamoylamino)ethyl]pyridine is sourced from PubChem (CID 94063709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).