1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine

C10H23N3O2S — CID 174864590

IUPAC1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine
SMILESCNS(=O)(=O)NC1CCN(CC(C)C)CC1
InChIInChI=1S/C10H23N3O2S/c1-9(2)8-13-6-4-10(5-7-13)12-16(14,15)11-3/h9-12H,4-8H2,1-3H3
InChIKeyJBDJFGKFXQVAFE-UHFFFAOYSA-N
MW249.38 g/mol
LogP0.16
Rot. Bonds5

About 1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine

1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine (PubChem CID 174864590) has the molecular formula C10H23N3O2S and a molecular weight of 249.38 g/mol. Its IUPAC name is 1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine.

Molecular Properties

Compound Name1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine
PubChem CID174864590
Molecular FormulaC10H23N3O2S
Molecular Weight249.38 g/mol
Exact Mass249.15
IUPAC Name1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine
SMILESCNS(=O)(=O)NC1CCN(CC(C)C)CC1
InChIInChI=1S/C10H23N3O2S/c1-9(2)8-13-6-4-10(5-7-13)12-16(14,15)11-3/h9-12H,4-8H2,1-3H3
InChIKeyJBDJFGKFXQVAFE-UHFFFAOYSA-N
XLogP0.16
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
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

N-[[1-(2-methylpropyl)piperidin-4-yl]methylsulfamoyl]cyclopentanamine
CID 110630173
2-[4-(methylsulfamoylamino)piperidin-1-yl]ethanethioamide
CID 114808399
N-(2-methyl-4-oxopentan-3-yl)-2-[4-(methylsulfamoylamino)piperidin-1-yl]acetamide
CID 139004941
1-(2-methylpropyl)-N-(2-methylsulfonylethyl)piperidin-4-amine
CID 103779495
2-methyl-3-(methylamino)-N-[1-(2-methylpropyl)piperidin-4-yl]propanamide
CID 119841116
N-(2-ethylsulfonylethyl)-1-(2-methylpropyl)piperidin-4-amine
CID 103780918
N-(2,2-dimethylpropyl)-1-(2-methylpropyl)piperidin-4-amine
CID 103640946
N-[1-(2-methylpropyl)piperidin-4-yl]propanamide
CID 71193586
N-(2,2-dimethylpropyl)-1-(2-methylpropyl)piperidin-4-amine;hydrochloride
CID 115607087
2-(methylamino)-N-[1-(2-methylpropyl)piperidin-4-yl]acetamide;dihydrochloride
CID 119841092
N-[3-(4-methylpiperidin-1-yl)propyl]-1-(2-methylpropyl)piperidin-4-amine
CID 103776314
3-methyl-1-[[1-(2-methylpropyl)piperidin-4-yl]amino]butan-2-ol
CID 103783971

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine?
The IUPAC name of 1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine (CID 174864590) is 1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine.
What is the SMILES notation for 1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine?
The canonical SMILES for 1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine is CNS(=O)(=O)NC1CCN(CC(C)C)CC1.
What is the InChIKey of 1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine?
The InChIKey is JBDJFGKFXQVAFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O2S/c1-9(2)8-13-6-4-10(5-7-13)12-16(14,15)11-3/h9-12H,4-8H2,1-3H3.
What are the key properties of 1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine?
1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine has a molecular weight of 249.38 g/mol, XLogP of 0.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)-N-(methylsulfamoyl)piperidin-4-amine is sourced from PubChem (CID 174864590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).