N-(dodecylsulfamoyl)formamide

C13H28N2O3S — CID 87822254

IUPACN-(dodecylsulfamoyl)formamide
SMILESCCCCCCCCCCCCNS(=O)(=O)NC=O
InChIInChI=1S/C13H28N2O3S/c1-2-3-4-5-6-7-8-9-10-11-12-14-19(17,18)15-13-16/h13-14H,2-12H2,1H3,(H,15,16)
InChIKeyXYGIFWRJXJZHFE-UHFFFAOYSA-N
MW292.44 g/mol
LogP2.49
Rot. Bonds14

About N-(dodecylsulfamoyl)formamide

N-(dodecylsulfamoyl)formamide (PubChem CID 87822254) has the molecular formula C13H28N2O3S and a molecular weight of 292.44 g/mol. Its IUPAC name is N-(dodecylsulfamoyl)formamide.

Molecular Properties

Compound NameN-(dodecylsulfamoyl)formamide
PubChem CID87822254
Molecular FormulaC13H28N2O3S
Molecular Weight292.44 g/mol
Exact Mass292.18
IUPAC NameN-(dodecylsulfamoyl)formamide
SMILESCCCCCCCCCCCCNS(=O)(=O)NC=O
InChIInChI=1S/C13H28N2O3S/c1-2-3-4-5-6-7-8-9-10-11-12-14-19(17,18)15-13-16/h13-14H,2-12H2,1H3,(H,15,16)
InChIKeyXYGIFWRJXJZHFE-UHFFFAOYSA-N
XLogP2.49
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.44
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,N'-dihexadecylmethanedisulfonamide
CID 140586841
N-pentacosylformamide
CID 88723962
N-tetracosylformamide
CID 54077607
N-octadecylpropane-1-sulfonamide
CID 88827291
N-decylbutane-1-sulfonamide
CID 19681427
1-(sulfamoylamino)octane;hydrofluoride
CID 175085495
sodium N-octadecylsulfamate
CID 87410765
N-[3-(pentylamino)propyl]methanesulfonamide
CID 106333021
ethane;N-pentylformamide
CID 145350301
azane;1-(sulfamoylamino)pentane
CID 87509026
N,N'-diheptylhexane-1,6-diamine
CID 3028571
octane;N-octylnonan-1-amine
CID 145152206

Frequently Asked Questions

What is the IUPAC name of N-(dodecylsulfamoyl)formamide?
The IUPAC name of N-(dodecylsulfamoyl)formamide (CID 87822254) is N-(dodecylsulfamoyl)formamide.
What is the SMILES notation for N-(dodecylsulfamoyl)formamide?
The canonical SMILES for N-(dodecylsulfamoyl)formamide is CCCCCCCCCCCCNS(=O)(=O)NC=O.
What is the InChIKey of N-(dodecylsulfamoyl)formamide?
The InChIKey is XYGIFWRJXJZHFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O3S/c1-2-3-4-5-6-7-8-9-10-11-12-14-19(17,18)15-13-16/h13-14H,2-12H2,1H3,(H,15,16).
What are the key properties of N-(dodecylsulfamoyl)formamide?
N-(dodecylsulfamoyl)formamide has a molecular weight of 292.44 g/mol, XLogP of 2.49, 14 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dodecylsulfamoyl)formamide is sourced from PubChem (CID 87822254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).