N-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride

C7H15ClN2O2S — CID 22326537

IUPACN-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride
SMILESCC1CC(C)CN(NS(=O)(=O)Cl)C1
InChIInChI=1S/C7H15ClN2O2S/c1-6-3-7(2)5-10(4-6)9-13(8,11)12/h6-7,9H,3-5H2,1-2H3
InChIKeySTFQYXIJDZBWDU-UHFFFAOYSA-N
MW226.73 g/mol
LogP0.95
Rot. Bonds2

About N-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride

N-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride (PubChem CID 22326537) has the molecular formula C7H15ClN2O2S and a molecular weight of 226.73 g/mol. Its IUPAC name is N-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride.

Molecular Properties

Compound NameN-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride
PubChem CID22326537
Molecular FormulaC7H15ClN2O2S
Molecular Weight226.73 g/mol
Exact Mass226.05
IUPAC NameN-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride
SMILESCC1CC(C)CN(NS(=O)(=O)Cl)C1
InChIInChI=1S/C7H15ClN2O2S/c1-6-3-7(2)5-10(4-6)9-13(8,11)12/h6-7,9H,3-5H2,1-2H3
InChIKeySTFQYXIJDZBWDU-UHFFFAOYSA-N
XLogP0.95
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.73
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 13271198
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CID 22326572
CID 22326572
CID 22326594
CID 22326594
CID 22326613
CID 22326613
CID 43132027
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CID 43210841
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CID 87976822
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CID 140093076
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CID 174221511
CID 174221511

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride?
The IUPAC name of N-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride (CID 22326537) is N-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride.
What is the SMILES notation for N-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride?
The canonical SMILES for N-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride is CC1CC(C)CN(NS(=O)(=O)Cl)C1.
What is the InChIKey of N-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride?
The InChIKey is STFQYXIJDZBWDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15ClN2O2S/c1-6-3-7(2)5-10(4-6)9-13(8,11)12/h6-7,9H,3-5H2,1-2H3.
What are the key properties of N-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride?
N-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride has a molecular weight of 226.73 g/mol, XLogP of 0.95, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylpiperidin-1-yl)sulfamoyl chloride is sourced from PubChem (CID 22326537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).