N-(1-adamantyl)sulfamoyl chloride

C10H16ClNO2S — CID 12682607

IUPACN-(1-adamantyl)sulfamoyl chloride
SMILESO=S(=O)(Cl)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C10H16ClNO2S/c11-15(13,14)12-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9,12H,1-6H2
InChIKeyRETPRRFLMYMURS-UHFFFAOYSA-N
MW249.76 g/mol
LogP2.03
Rot. Bonds2

About N-(1-adamantyl)sulfamoyl chloride

N-(1-adamantyl)sulfamoyl chloride (PubChem CID 12682607) has the molecular formula C10H16ClNO2S and a molecular weight of 249.76 g/mol. Its IUPAC name is N-(1-adamantyl)sulfamoyl chloride.

Molecular Properties

Compound NameN-(1-adamantyl)sulfamoyl chloride
PubChem CID12682607
Molecular FormulaC10H16ClNO2S
Molecular Weight249.76 g/mol
Exact Mass249.06
IUPAC NameN-(1-adamantyl)sulfamoyl chloride
SMILESO=S(=O)(Cl)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C10H16ClNO2S/c11-15(13,14)12-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9,12H,1-6H2
InChIKeyRETPRRFLMYMURS-UHFFFAOYSA-N
XLogP2.03
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.76
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-adamantyl)sulfamoyl chloride?
The IUPAC name of N-(1-adamantyl)sulfamoyl chloride (CID 12682607) is N-(1-adamantyl)sulfamoyl chloride.
What is the SMILES notation for N-(1-adamantyl)sulfamoyl chloride?
The canonical SMILES for N-(1-adamantyl)sulfamoyl chloride is O=S(=O)(Cl)NC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N-(1-adamantyl)sulfamoyl chloride?
The InChIKey is RETPRRFLMYMURS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16ClNO2S/c11-15(13,14)12-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9,12H,1-6H2.
What are the key properties of N-(1-adamantyl)sulfamoyl chloride?
N-(1-adamantyl)sulfamoyl chloride has a molecular weight of 249.76 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantyl)sulfamoyl chloride is sourced from PubChem (CID 12682607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).