2-methyl-N-(2-methylpropyl)propane-2-sulfinamide

C8H19NOS — CID 149151884

IUPAC2-methyl-N-(2-methylpropyl)propane-2-sulfinamide
SMILESCC(C)CNS(=O)C(C)(C)C
InChIInChI=1S/C8H19NOS/c1-7(2)6-9-11(10)8(3,4)5/h7,9H,6H2,1-5H3
InChIKeyPWWFJVYMBQWWAX-UHFFFAOYSA-N
MW177.31 g/mol
LogP1.69
Rot. Bonds3

About 2-methyl-N-(2-methylpropyl)propane-2-sulfinamide

2-methyl-N-(2-methylpropyl)propane-2-sulfinamide (PubChem CID 149151884) has the molecular formula C8H19NOS and a molecular weight of 177.31 g/mol. Its IUPAC name is 2-methyl-N-(2-methylpropyl)propane-2-sulfinamide.

Molecular Properties

Compound Name2-methyl-N-(2-methylpropyl)propane-2-sulfinamide
PubChem CID149151884
Molecular FormulaC8H19NOS
Molecular Weight177.31 g/mol
Exact Mass177.12
IUPAC Name2-methyl-N-(2-methylpropyl)propane-2-sulfinamide
SMILESCC(C)CNS(=O)C(C)(C)C
InChIInChI=1S/C8H19NOS/c1-7(2)6-9-11(10)8(3,4)5/h7,9H,6H2,1-5H3
InChIKeyPWWFJVYMBQWWAX-UHFFFAOYSA-N
XLogP1.69
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.31
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methylpropyl)propane-2-sulfinamide?
The IUPAC name of 2-methyl-N-(2-methylpropyl)propane-2-sulfinamide (CID 149151884) is 2-methyl-N-(2-methylpropyl)propane-2-sulfinamide.
What is the SMILES notation for 2-methyl-N-(2-methylpropyl)propane-2-sulfinamide?
The canonical SMILES for 2-methyl-N-(2-methylpropyl)propane-2-sulfinamide is CC(C)CNS(=O)C(C)(C)C.
What is the InChIKey of 2-methyl-N-(2-methylpropyl)propane-2-sulfinamide?
The InChIKey is PWWFJVYMBQWWAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NOS/c1-7(2)6-9-11(10)8(3,4)5/h7,9H,6H2,1-5H3.
What are the key properties of 2-methyl-N-(2-methylpropyl)propane-2-sulfinamide?
2-methyl-N-(2-methylpropyl)propane-2-sulfinamide has a molecular weight of 177.31 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methylpropyl)propane-2-sulfinamide is sourced from PubChem (CID 149151884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).