N-(pentylsulfamoyl)cyclohexanamine

C11H24N2O2S — CID 15569634

IUPACN-(pentylsulfamoyl)cyclohexanamine
SMILESCCCCCNS(=O)(=O)NC1CCCCC1
InChIInChI=1S/C11H24N2O2S/c1-2-3-7-10-12-16(14,15)13-11-8-5-4-6-9-11/h11-13H,2-10H2,1H3
InChIKeyDNLQONCQTWURCM-UHFFFAOYSA-N
MW248.39 g/mol
LogP1.93
Rot. Bonds7

About N-(pentylsulfamoyl)cyclohexanamine

N-(pentylsulfamoyl)cyclohexanamine (PubChem CID 15569634) has the molecular formula C11H24N2O2S and a molecular weight of 248.39 g/mol. Its IUPAC name is N-(pentylsulfamoyl)cyclohexanamine.

Molecular Properties

Compound NameN-(pentylsulfamoyl)cyclohexanamine
PubChem CID15569634
Molecular FormulaC11H24N2O2S
Molecular Weight248.39 g/mol
Exact Mass248.16
IUPAC NameN-(pentylsulfamoyl)cyclohexanamine
SMILESCCCCCNS(=O)(=O)NC1CCCCC1
InChIInChI=1S/C11H24N2O2S/c1-2-3-7-10-12-16(14,15)13-11-8-5-4-6-9-11/h11-13H,2-10H2,1H3
InChIKeyDNLQONCQTWURCM-UHFFFAOYSA-N
XLogP1.93
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(pentylsulfamoyl)cyclohexanamine?
The IUPAC name of N-(pentylsulfamoyl)cyclohexanamine (CID 15569634) is N-(pentylsulfamoyl)cyclohexanamine.
What is the SMILES notation for N-(pentylsulfamoyl)cyclohexanamine?
The canonical SMILES for N-(pentylsulfamoyl)cyclohexanamine is CCCCCNS(=O)(=O)NC1CCCCC1.
What is the InChIKey of N-(pentylsulfamoyl)cyclohexanamine?
The InChIKey is DNLQONCQTWURCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2S/c1-2-3-7-10-12-16(14,15)13-11-8-5-4-6-9-11/h11-13H,2-10H2,1H3.
What are the key properties of N-(pentylsulfamoyl)cyclohexanamine?
N-(pentylsulfamoyl)cyclohexanamine has a molecular weight of 248.39 g/mol, XLogP of 1.93, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pentylsulfamoyl)cyclohexanamine is sourced from PubChem (CID 15569634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).