4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine

C14H29N3O2S — CID 70551613

IUPAC4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine
SMILESCN(CCC1CCNCC1)S(=O)(=O)NC1CCCCC1
InChIInChI=1S/C14H29N3O2S/c1-17(12-9-13-7-10-15-11-8-13)20(18,19)16-14-5-3-2-4-6-14/h13-16H,2-12H2,1H3
InChIKeyIGJRXIYULDAIHH-UHFFFAOYSA-N
MW303.47 g/mol
LogP1.48
Rot. Bonds6

About 4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine

4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine (PubChem CID 70551613) has the molecular formula C14H29N3O2S and a molecular weight of 303.47 g/mol. Its IUPAC name is 4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine.

Molecular Properties

Compound Name4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine
PubChem CID70551613
Molecular FormulaC14H29N3O2S
Molecular Weight303.47 g/mol
Exact Mass303.20
IUPAC Name4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine
SMILESCN(CCC1CCNCC1)S(=O)(=O)NC1CCCCC1
InChIInChI=1S/C14H29N3O2S/c1-17(12-9-13-7-10-15-11-8-13)20(18,19)16-14-5-3-2-4-6-14/h13-16H,2-12H2,1H3
InChIKeyIGJRXIYULDAIHH-UHFFFAOYSA-N
XLogP1.48
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.47
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine?
The IUPAC name of 4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine (CID 70551613) is 4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine.
What is the SMILES notation for 4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine?
The canonical SMILES for 4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine is CN(CCC1CCNCC1)S(=O)(=O)NC1CCCCC1.
What is the InChIKey of 4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine?
The InChIKey is IGJRXIYULDAIHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2S/c1-17(12-9-13-7-10-15-11-8-13)20(18,19)16-14-5-3-2-4-6-14/h13-16H,2-12H2,1H3.
What are the key properties of 4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine?
4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine has a molecular weight of 303.47 g/mol, XLogP of 1.48, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine is sourced from PubChem (CID 70551613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).