N-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine

C9H21N3O2S — CID 60807042

IUPACN-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine
SMILESCCN(C1CCCNC1)S(=O)(=O)N(C)C
InChIInChI=1S/C9H21N3O2S/c1-4-12(15(13,14)11(2)3)9-6-5-7-10-8-9/h9-10H,4-8H2,1-3H3
InChIKeyNGLPFKRPWXWNPJ-UHFFFAOYSA-N
MW235.35 g/mol
LogP-0.13
Rot. Bonds4

About N-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine

N-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine (PubChem CID 60807042) has the molecular formula C9H21N3O2S and a molecular weight of 235.35 g/mol. Its IUPAC name is N-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine.

Molecular Properties

Compound NameN-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine
PubChem CID60807042
Molecular FormulaC9H21N3O2S
Molecular Weight235.35 g/mol
Exact Mass235.14
IUPAC NameN-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine
SMILESCCN(C1CCCNC1)S(=O)(=O)N(C)C
InChIInChI=1S/C9H21N3O2S/c1-4-12(15(13,14)11(2)3)9-6-5-7-10-8-9/h9-10H,4-8H2,1-3H3
InChIKeyNGLPFKRPWXWNPJ-UHFFFAOYSA-N
XLogP-0.13
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine?
The IUPAC name of N-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine (CID 60807042) is N-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine.
What is the SMILES notation for N-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine?
The canonical SMILES for N-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine is CCN(C1CCCNC1)S(=O)(=O)N(C)C.
What is the InChIKey of N-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine?
The InChIKey is NGLPFKRPWXWNPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O2S/c1-4-12(15(13,14)11(2)3)9-6-5-7-10-8-9/h9-10H,4-8H2,1-3H3.
What are the key properties of N-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine?
N-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine has a molecular weight of 235.35 g/mol, XLogP of -0.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dimethylsulfamoyl)-N-ethylpiperidin-3-amine is sourced from PubChem (CID 60807042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).