1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine

C9H21N3O2S — CID 155183420

IUPAC1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine
SMILESCC(C)NS(=O)(=O)NC1CCN(C)CC1
InChIInChI=1S/C9H21N3O2S/c1-8(2)10-15(13,14)11-9-4-6-12(3)7-5-9/h8-11H,4-7H2,1-3H3
InChIKeyCFSCZHPCTVEBGD-UHFFFAOYSA-N
MW235.35 g/mol
LogP-0.09
Rot. Bonds4

About 1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine

1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine (PubChem CID 155183420) has the molecular formula C9H21N3O2S and a molecular weight of 235.35 g/mol. Its IUPAC name is 1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine.

Molecular Properties

Compound Name1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine
PubChem CID155183420
Molecular FormulaC9H21N3O2S
Molecular Weight235.35 g/mol
Exact Mass235.14
IUPAC Name1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine
SMILESCC(C)NS(=O)(=O)NC1CCN(C)CC1
InChIInChI=1S/C9H21N3O2S/c1-8(2)10-15(13,14)11-9-4-6-12(3)7-5-9/h8-11H,4-7H2,1-3H3
InChIKeyCFSCZHPCTVEBGD-UHFFFAOYSA-N
XLogP-0.09
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine?
The IUPAC name of 1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine (CID 155183420) is 1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine.
What is the SMILES notation for 1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine?
The canonical SMILES for 1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine is CC(C)NS(=O)(=O)NC1CCN(C)CC1.
What is the InChIKey of 1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine?
The InChIKey is CFSCZHPCTVEBGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O2S/c1-8(2)10-15(13,14)11-9-4-6-12(3)7-5-9/h8-11H,4-7H2,1-3H3.
What are the key properties of 1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine?
1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine has a molecular weight of 235.35 g/mol, XLogP of -0.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(propan-2-ylsulfamoyl)piperidin-4-amine is sourced from PubChem (CID 155183420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).