7-methyl-N-(methylsulfamoyl)tetradecan-7-amine

C16H36N2O2S — CID 139493417

IUPAC7-methyl-N-(methylsulfamoyl)tetradecan-7-amine
SMILESCCCCCCCC(C)(CCCCCC)NS(=O)(=O)NC
InChIInChI=1S/C16H36N2O2S/c1-5-7-9-11-13-15-16(3,14-12-10-8-6-2)18-21(19,20)17-4/h17-18H,5-15H2,1-4H3
InChIKeyFVCRPTNGQSJFRF-UHFFFAOYSA-N
MW320.54 g/mol
LogP4.13
Rot. Bonds14

About 7-methyl-N-(methylsulfamoyl)tetradecan-7-amine

7-methyl-N-(methylsulfamoyl)tetradecan-7-amine (PubChem CID 139493417) has the molecular formula C16H36N2O2S and a molecular weight of 320.54 g/mol. Its IUPAC name is 7-methyl-N-(methylsulfamoyl)tetradecan-7-amine.

Molecular Properties

Compound Name7-methyl-N-(methylsulfamoyl)tetradecan-7-amine
PubChem CID139493417
Molecular FormulaC16H36N2O2S
Molecular Weight320.54 g/mol
Exact Mass320.25
IUPAC Name7-methyl-N-(methylsulfamoyl)tetradecan-7-amine
SMILESCCCCCCCC(C)(CCCCCC)NS(=O)(=O)NC
InChIInChI=1S/C16H36N2O2S/c1-5-7-9-11-13-15-16(3,14-12-10-8-6-2)18-21(19,20)17-4/h17-18H,5-15H2,1-4H3
InChIKeyFVCRPTNGQSJFRF-UHFFFAOYSA-N
XLogP4.13
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.54
LogP ≤ 54.13
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 7-methyl-N-(methylsulfamoyl)tetradecan-7-amine?
The IUPAC name of 7-methyl-N-(methylsulfamoyl)tetradecan-7-amine (CID 139493417) is 7-methyl-N-(methylsulfamoyl)tetradecan-7-amine.
What is the SMILES notation for 7-methyl-N-(methylsulfamoyl)tetradecan-7-amine?
The canonical SMILES for 7-methyl-N-(methylsulfamoyl)tetradecan-7-amine is CCCCCCCC(C)(CCCCCC)NS(=O)(=O)NC.
What is the InChIKey of 7-methyl-N-(methylsulfamoyl)tetradecan-7-amine?
The InChIKey is FVCRPTNGQSJFRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36N2O2S/c1-5-7-9-11-13-15-16(3,14-12-10-8-6-2)18-21(19,20)17-4/h17-18H,5-15H2,1-4H3.
What are the key properties of 7-methyl-N-(methylsulfamoyl)tetradecan-7-amine?
7-methyl-N-(methylsulfamoyl)tetradecan-7-amine has a molecular weight of 320.54 g/mol, XLogP of 4.13, 14 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-(methylsulfamoyl)tetradecan-7-amine is sourced from PubChem (CID 139493417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).