N-propylpropane-2-sulfinamide

C6H15NOS — CID 89074184

IUPACN-propylpropane-2-sulfinamide
SMILESCCCNS(=O)C(C)C
InChIInChI=1S/C6H15NOS/c1-4-5-7-9(8)6(2)3/h6-7H,4-5H2,1-3H3
InChIKeySDRIJSGYJOGFIM-UHFFFAOYSA-N
MW149.26 g/mol
LogP1.06
Rot. Bonds4

About N-propylpropane-2-sulfinamide

N-propylpropane-2-sulfinamide (PubChem CID 89074184) has the molecular formula C6H15NOS and a molecular weight of 149.26 g/mol. Its IUPAC name is N-propylpropane-2-sulfinamide.

Molecular Properties

Compound NameN-propylpropane-2-sulfinamide
PubChem CID89074184
Molecular FormulaC6H15NOS
Molecular Weight149.26 g/mol
Exact Mass149.09
IUPAC NameN-propylpropane-2-sulfinamide
SMILESCCCNS(=O)C(C)C
InChIInChI=1S/C6H15NOS/c1-4-5-7-9(8)6(2)3/h6-7H,4-5H2,1-3H3
InChIKeySDRIJSGYJOGFIM-UHFFFAOYSA-N
XLogP1.06
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.26
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-propylpropane-2-sulfinamide?
The IUPAC name of N-propylpropane-2-sulfinamide (CID 89074184) is N-propylpropane-2-sulfinamide.
What is the SMILES notation for N-propylpropane-2-sulfinamide?
The canonical SMILES for N-propylpropane-2-sulfinamide is CCCNS(=O)C(C)C.
What is the InChIKey of N-propylpropane-2-sulfinamide?
The InChIKey is SDRIJSGYJOGFIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NOS/c1-4-5-7-9(8)6(2)3/h6-7H,4-5H2,1-3H3.
What are the key properties of N-propylpropane-2-sulfinamide?
N-propylpropane-2-sulfinamide has a molecular weight of 149.26 g/mol, XLogP of 1.06, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propylpropane-2-sulfinamide is sourced from PubChem (CID 89074184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).