2-methyl-N-propylpropane-2-sulfinamide

C7H17NOS — CID 86229710

IUPAC2-methyl-N-propylpropane-2-sulfinamide
SMILESCCCNS(=O)C(C)(C)C
InChIInChI=1S/C7H17NOS/c1-5-6-8-10(9)7(2,3)4/h8H,5-6H2,1-4H3
InChIKeySCDDZPIYMIUTKB-UHFFFAOYSA-N
MW163.29 g/mol
LogP1.45
Rot. Bonds3

About 2-methyl-N-propylpropane-2-sulfinamide

2-methyl-N-propylpropane-2-sulfinamide (PubChem CID 86229710) has the molecular formula C7H17NOS and a molecular weight of 163.29 g/mol. Its IUPAC name is 2-methyl-N-propylpropane-2-sulfinamide.

Molecular Properties

Compound Name2-methyl-N-propylpropane-2-sulfinamide
PubChem CID86229710
Molecular FormulaC7H17NOS
Molecular Weight163.29 g/mol
Exact Mass163.10
IUPAC Name2-methyl-N-propylpropane-2-sulfinamide
SMILESCCCNS(=O)C(C)(C)C
InChIInChI=1S/C7H17NOS/c1-5-6-8-10(9)7(2,3)4/h8H,5-6H2,1-4H3
InChIKeySCDDZPIYMIUTKB-UHFFFAOYSA-N
XLogP1.45
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.29
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-methyl-N-propylpropane-2-sulfinamide with MolForge

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

Launch Full Analysis

Related Compounds

N,2-Dimethyl-2-propanesulfinamide
CID 21703076
Tert-butyl-(1-fluoroethylamino)-oxidosulfanium
CID 174043686
2-methyl-N-(2-methylpropyl)propane-2-sulfinamide
CID 149151884
(R)-N-[(2S)-butan-2-yl]-2-methylpropane-2-sulfinamide
CID 15455975
(R)-N-[(2R)-butan-2-yl]-2-methylpropane-2-sulfinamide
CID 135056564
N-ethyl-2-methylpropane-1-sulfinamide
CID 21703050
N-ethyl-2-methylpropane-2-sulfinamide
CID 21703054
N-ethylpropane-2-sulfinamide
CID 21703066
N-ethylbutane-2-sulfinamide
CID 21703068
Ethyl-tert-butyl-sulfonamide
CID 21703069
2-methyl-N-propylpropane-2-sulfonamide
CID 22364465
N-ethylbutane-1-sulfinamide
CID 53651139

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-propylpropane-2-sulfinamide?
The IUPAC name of 2-methyl-N-propylpropane-2-sulfinamide (CID 86229710) is 2-methyl-N-propylpropane-2-sulfinamide.
What is the SMILES notation for 2-methyl-N-propylpropane-2-sulfinamide?
The canonical SMILES for 2-methyl-N-propylpropane-2-sulfinamide is CCCNS(=O)C(C)(C)C.
What is the InChIKey of 2-methyl-N-propylpropane-2-sulfinamide?
The InChIKey is SCDDZPIYMIUTKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NOS/c1-5-6-8-10(9)7(2,3)4/h8H,5-6H2,1-4H3.
What are the key properties of 2-methyl-N-propylpropane-2-sulfinamide?
2-methyl-N-propylpropane-2-sulfinamide has a molecular weight of 163.29 g/mol, XLogP of 1.45, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-propylpropane-2-sulfinamide is sourced from PubChem (CID 86229710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).