N-propan-2-ylpropane-2-sulfonamide

C6H15NO2S — CID 19021602

IUPACN-propan-2-ylpropane-2-sulfonamide
SMILESCC(C)NS(=O)(=O)C(C)C
InChIInChI=1S/C6H15NO2S/c1-5(2)7-10(8,9)6(3)4/h5-7H,1-4H3
InChIKeyRSHRPFCSXIEKID-UHFFFAOYSA-N
MW165.26 g/mol
LogP0.72
Rot. Bonds3

About N-propan-2-ylpropane-2-sulfonamide

N-propan-2-ylpropane-2-sulfonamide (PubChem CID 19021602) has the molecular formula C6H15NO2S and a molecular weight of 165.26 g/mol. Its IUPAC name is N-propan-2-ylpropane-2-sulfonamide.

Molecular Properties

Compound NameN-propan-2-ylpropane-2-sulfonamide
PubChem CID19021602
Molecular FormulaC6H15NO2S
Molecular Weight165.26 g/mol
Exact Mass165.08
IUPAC NameN-propan-2-ylpropane-2-sulfonamide
SMILESCC(C)NS(=O)(=O)C(C)C
InChIInChI=1S/C6H15NO2S/c1-5(2)7-10(8,9)6(3)4/h5-7H,1-4H3
InChIKeyRSHRPFCSXIEKID-UHFFFAOYSA-N
XLogP0.72
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.26
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-ylpropane-2-sulfonamide?
The IUPAC name of N-propan-2-ylpropane-2-sulfonamide (CID 19021602) is N-propan-2-ylpropane-2-sulfonamide.
What is the SMILES notation for N-propan-2-ylpropane-2-sulfonamide?
The canonical SMILES for N-propan-2-ylpropane-2-sulfonamide is CC(C)NS(=O)(=O)C(C)C.
What is the InChIKey of N-propan-2-ylpropane-2-sulfonamide?
The InChIKey is RSHRPFCSXIEKID-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO2S/c1-5(2)7-10(8,9)6(3)4/h5-7H,1-4H3.
What are the key properties of N-propan-2-ylpropane-2-sulfonamide?
N-propan-2-ylpropane-2-sulfonamide has a molecular weight of 165.26 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-ylpropane-2-sulfonamide is sourced from PubChem (CID 19021602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).