N-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine

C11H25N3O2S — CID 63644066

IUPACN-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine
SMILESCCCCN(C)S(=O)(=O)N(C)C1CCCNC1
InChIInChI=1S/C11H25N3O2S/c1-4-5-9-13(2)17(15,16)14(3)11-7-6-8-12-10-11/h11-12H,4-10H2,1-3H3
InChIKeyWZQOBGZVCKEQKU-UHFFFAOYSA-N
MW263.41 g/mol
LogP0.65
Rot. Bonds6

About N-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine

N-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine (PubChem CID 63644066) has the molecular formula C11H25N3O2S and a molecular weight of 263.41 g/mol. Its IUPAC name is N-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine.

Molecular Properties

Compound NameN-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine
PubChem CID63644066
Molecular FormulaC11H25N3O2S
Molecular Weight263.41 g/mol
Exact Mass263.17
IUPAC NameN-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine
SMILESCCCCN(C)S(=O)(=O)N(C)C1CCCNC1
InChIInChI=1S/C11H25N3O2S/c1-4-5-9-13(2)17(15,16)14(3)11-7-6-8-12-10-11/h11-12H,4-10H2,1-3H3
InChIKeyWZQOBGZVCKEQKU-UHFFFAOYSA-N
XLogP0.65
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.41
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine?
The IUPAC name of N-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine (CID 63644066) is N-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine.
What is the SMILES notation for N-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine?
The canonical SMILES for N-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine is CCCCN(C)S(=O)(=O)N(C)C1CCCNC1.
What is the InChIKey of N-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine?
The InChIKey is WZQOBGZVCKEQKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O2S/c1-4-5-9-13(2)17(15,16)14(3)11-7-6-8-12-10-11/h11-12H,4-10H2,1-3H3.
What are the key properties of N-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine?
N-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine has a molecular weight of 263.41 g/mol, XLogP of 0.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine is sourced from PubChem (CID 63644066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).