3-[[methylsulfamoyl(propyl)amino]methyl]piperidine

C10H23N3O2S — CID 106631336

IUPAC3-[[methylsulfamoyl(propyl)amino]methyl]piperidine
SMILESCCCN(CC1CCCNC1)S(=O)(=O)NC
InChIInChI=1S/C10H23N3O2S/c1-3-7-13(16(14,15)11-2)9-10-5-4-6-12-8-10/h10-12H,3-9H2,1-2H3
InChIKeyAUYODFMODVVIGB-UHFFFAOYSA-N
MW249.38 g/mol
LogP0.16
Rot. Bonds6

About 3-[[methylsulfamoyl(propyl)amino]methyl]piperidine

3-[[methylsulfamoyl(propyl)amino]methyl]piperidine (PubChem CID 106631336) has the molecular formula C10H23N3O2S and a molecular weight of 249.38 g/mol. Its IUPAC name is 3-[[methylsulfamoyl(propyl)amino]methyl]piperidine.

Molecular Properties

Compound Name3-[[methylsulfamoyl(propyl)amino]methyl]piperidine
PubChem CID106631336
Molecular FormulaC10H23N3O2S
Molecular Weight249.38 g/mol
Exact Mass249.15
IUPAC Name3-[[methylsulfamoyl(propyl)amino]methyl]piperidine
SMILESCCCN(CC1CCCNC1)S(=O)(=O)NC
InChIInChI=1S/C10H23N3O2S/c1-3-7-13(16(14,15)11-2)9-10-5-4-6-12-8-10/h10-12H,3-9H2,1-2H3
InChIKeyAUYODFMODVVIGB-UHFFFAOYSA-N
XLogP0.16
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-methylpropylsulfamoyl(propyl)amino]methyl]piperidine
CID 106631308
4-[[methylsulfamoyl(propyl)amino]methyl]piperidine
CID 114811132
N-(piperidin-3-ylmethyl)-N-propylcyclopentanesulfonamide
CID 106631385
1-cyclohexyl-N-(piperidin-3-ylmethyl)-N-propylmethanesulfonamide
CID 106631342
N-(piperidin-3-ylmethyl)-N-propylbutane-1-sulfonamide
CID 106631296
1-cyano-N-(piperidin-3-ylmethyl)-N-propylmethanesulfonamide
CID 106631368
4-fluoro-N-(piperidin-3-ylmethyl)-N-propylbenzenesulfonamide
CID 106631281
N-(2-hydroxyethyl)-1-piperidin-3-yl-N-propylmethanesulfonamide
CID 54972143
3-[[[cyclopropylmethyl(methyl)sulfamoyl]amino]methyl]piperidine
CID 119968280
5-bromo-3-methyl-N-(piperidin-3-ylmethyl)-N-propyltriazole-4-sulfonamide
CID 106631322
5-cyano-N-(piperidin-3-ylmethyl)-N-propylthiophene-2-sulfonamide
CID 106273114
3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride
CID 119979613

Frequently Asked Questions

What is the IUPAC name of 3-[[methylsulfamoyl(propyl)amino]methyl]piperidine?
The IUPAC name of 3-[[methylsulfamoyl(propyl)amino]methyl]piperidine (CID 106631336) is 3-[[methylsulfamoyl(propyl)amino]methyl]piperidine.
What is the SMILES notation for 3-[[methylsulfamoyl(propyl)amino]methyl]piperidine?
The canonical SMILES for 3-[[methylsulfamoyl(propyl)amino]methyl]piperidine is CCCN(CC1CCCNC1)S(=O)(=O)NC.
What is the InChIKey of 3-[[methylsulfamoyl(propyl)amino]methyl]piperidine?
The InChIKey is AUYODFMODVVIGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O2S/c1-3-7-13(16(14,15)11-2)9-10-5-4-6-12-8-10/h10-12H,3-9H2,1-2H3.
What are the key properties of 3-[[methylsulfamoyl(propyl)amino]methyl]piperidine?
3-[[methylsulfamoyl(propyl)amino]methyl]piperidine has a molecular weight of 249.38 g/mol, XLogP of 0.16, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[methylsulfamoyl(propyl)amino]methyl]piperidine is sourced from PubChem (CID 106631336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).