4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine

C8H19N3O3S — CID 112689198

IUPAC4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine
SMILESCN1CCC(N(CCO)S(N)(=O)=O)CC1
InChIInChI=1S/C8H19N3O3S/c1-10-4-2-8(3-5-10)11(6-7-12)15(9,13)14/h8,12H,2-7H2,1H3,(H2,9,13,14)
InChIKeyOSICDWLTYQEXBN-UHFFFAOYSA-N
MW237.32 g/mol
LogP-1.42
Rot. Bonds4

About 4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine

4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine (PubChem CID 112689198) has the molecular formula C8H19N3O3S and a molecular weight of 237.32 g/mol. Its IUPAC name is 4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine.

Molecular Properties

Compound Name4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine
PubChem CID112689198
Molecular FormulaC8H19N3O3S
Molecular Weight237.32 g/mol
Exact Mass237.11
IUPAC Name4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine
SMILESCN1CCC(N(CCO)S(N)(=O)=O)CC1
InChIInChI=1S/C8H19N3O3S/c1-10-4-2-8(3-5-10)11(6-7-12)15(9,13)14/h8,12H,2-7H2,1H3,(H2,9,13,14)
InChIKeyOSICDWLTYQEXBN-UHFFFAOYSA-N
XLogP-1.42
TPSA86.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 5-1.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine?
The IUPAC name of 4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine (CID 112689198) is 4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine.
What is the SMILES notation for 4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine?
The canonical SMILES for 4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine is CN1CCC(N(CCO)S(N)(=O)=O)CC1.
What is the InChIKey of 4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine?
The InChIKey is OSICDWLTYQEXBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O3S/c1-10-4-2-8(3-5-10)11(6-7-12)15(9,13)14/h8,12H,2-7H2,1H3,(H2,9,13,14).
What are the key properties of 4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine?
4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine has a molecular weight of 237.32 g/mol, XLogP of -1.42, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-hydroxyethyl(sulfamoyl)amino]-1-methylpiperidine is sourced from PubChem (CID 112689198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).