1-(dimethylsulfamoylamino)adamantane

C12H22N2O2S — CID 35326743

IUPAC1-(dimethylsulfamoylamino)adamantane
SMILESCN(C)S(=O)(=O)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C12H22N2O2S/c1-14(2)17(15,16)13-12-6-9-3-10(7-12)5-11(4-9)8-12/h9-11,13H,3-8H2,1-2H3
InChIKeyRVVDFUWBYINLFP-UHFFFAOYSA-N
MW258.39 g/mol
LogP1.35
Rot. Bonds3

About 1-(dimethylsulfamoylamino)adamantane

1-(dimethylsulfamoylamino)adamantane (PubChem CID 35326743) has the molecular formula C12H22N2O2S and a molecular weight of 258.39 g/mol. Its IUPAC name is 1-(dimethylsulfamoylamino)adamantane.

Molecular Properties

Compound Name1-(dimethylsulfamoylamino)adamantane
PubChem CID35326743
Molecular FormulaC12H22N2O2S
Molecular Weight258.39 g/mol
Exact Mass258.14
IUPAC Name1-(dimethylsulfamoylamino)adamantane
SMILESCN(C)S(=O)(=O)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C12H22N2O2S/c1-14(2)17(15,16)13-12-6-9-3-10(7-12)5-11(4-9)8-12/h9-11,13H,3-8H2,1-2H3
InChIKeyRVVDFUWBYINLFP-UHFFFAOYSA-N
XLogP1.35
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.39
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(dimethylsulfamoylamino)adamantane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylsulfamoylamino)adamantane?
The IUPAC name of 1-(dimethylsulfamoylamino)adamantane (CID 35326743) is 1-(dimethylsulfamoylamino)adamantane.
What is the SMILES notation for 1-(dimethylsulfamoylamino)adamantane?
The canonical SMILES for 1-(dimethylsulfamoylamino)adamantane is CN(C)S(=O)(=O)NC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of 1-(dimethylsulfamoylamino)adamantane?
The InChIKey is RVVDFUWBYINLFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2S/c1-14(2)17(15,16)13-12-6-9-3-10(7-12)5-11(4-9)8-12/h9-11,13H,3-8H2,1-2H3.
What are the key properties of 1-(dimethylsulfamoylamino)adamantane?
1-(dimethylsulfamoylamino)adamantane has a molecular weight of 258.39 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylsulfamoylamino)adamantane is sourced from PubChem (CID 35326743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).