4-(dimethylsulfamoylamino)-1-methylpiperidine

C8H19N3O2S — CID 23537508

IUPAC4-(dimethylsulfamoylamino)-1-methylpiperidine
SMILESCN1CCC(NS(=O)(=O)N(C)C)CC1
InChIInChI=1S/C8H19N3O2S/c1-10(2)14(12,13)9-8-4-6-11(3)7-5-8/h8-9H,4-7H2,1-3H3
InChIKeyPLEXRWFPZZORHY-UHFFFAOYSA-N
MW221.33 g/mol
LogP-0.52
Rot. Bonds3

About 4-(dimethylsulfamoylamino)-1-methylpiperidine

4-(dimethylsulfamoylamino)-1-methylpiperidine (PubChem CID 23537508) has the molecular formula C8H19N3O2S and a molecular weight of 221.33 g/mol. Its IUPAC name is 4-(dimethylsulfamoylamino)-1-methylpiperidine.

Molecular Properties

Compound Name4-(dimethylsulfamoylamino)-1-methylpiperidine
PubChem CID23537508
Molecular FormulaC8H19N3O2S
Molecular Weight221.33 g/mol
Exact Mass221.12
IUPAC Name4-(dimethylsulfamoylamino)-1-methylpiperidine
SMILESCN1CCC(NS(=O)(=O)N(C)C)CC1
InChIInChI=1S/C8H19N3O2S/c1-10(2)14(12,13)9-8-4-6-11(3)7-5-8/h8-9H,4-7H2,1-3H3
InChIKeyPLEXRWFPZZORHY-UHFFFAOYSA-N
XLogP-0.52
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 5-0.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoylamino)-1-methylpiperidine?
The IUPAC name of 4-(dimethylsulfamoylamino)-1-methylpiperidine (CID 23537508) is 4-(dimethylsulfamoylamino)-1-methylpiperidine.
What is the SMILES notation for 4-(dimethylsulfamoylamino)-1-methylpiperidine?
The canonical SMILES for 4-(dimethylsulfamoylamino)-1-methylpiperidine is CN1CCC(NS(=O)(=O)N(C)C)CC1.
What is the InChIKey of 4-(dimethylsulfamoylamino)-1-methylpiperidine?
The InChIKey is PLEXRWFPZZORHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O2S/c1-10(2)14(12,13)9-8-4-6-11(3)7-5-8/h8-9H,4-7H2,1-3H3.
What are the key properties of 4-(dimethylsulfamoylamino)-1-methylpiperidine?
4-(dimethylsulfamoylamino)-1-methylpiperidine has a molecular weight of 221.33 g/mol, XLogP of -0.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoylamino)-1-methylpiperidine is sourced from PubChem (CID 23537508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).