About N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine
N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine (PubChem CID 114811401) has the molecular formula C9H19N3O2S
and a molecular weight of 233.34 g/mol. Its IUPAC name is N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine.
Molecular Properties
| Compound Name | N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine |
| PubChem CID | 114811401 |
| Molecular Formula | C9H19N3O2S |
| Molecular Weight | 233.34 g/mol |
| Exact Mass | 233.12 |
| IUPAC Name | N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine |
| SMILES | CC1(NS(=O)(=O)NC2CC2)CCNCC1 |
| InChI | InChI=1S/C9H19N3O2S/c1-9(4-6-10-7-5-9)12-15(13,14)11-8-2-3-8/h8,10-12H,2-7H2,1H3 |
| InChIKey | ZPJZFEOFPFCCAY-UHFFFAOYSA-N |
| XLogP | -0.29 |
| TPSA | 70.23 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 233.34 |
| LogP ≤ 5 | -0.29 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine?
The IUPAC name of N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine (CID 114811401) is N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine.
What is the SMILES notation for N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine?
The canonical SMILES for N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine is CC1(NS(=O)(=O)NC2CC2)CCNCC1.
What is the InChIKey of N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine?
The InChIKey is ZPJZFEOFPFCCAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2S/c1-9(4-6-10-7-5-9)12-15(13,14)11-8-2-3-8/h8,10-12H,2-7H2,1H3.
What are the key properties of N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine?
N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine has a molecular weight of 233.34 g/mol, XLogP of -0.29, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine is sourced from PubChem (CID 114811401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).