2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide

C11H24N2O3S — CID 61408971

IUPAC2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide
SMILESCCCN(CCC)S(=O)(=O)N1CCCC1CO
InChIInChI=1S/C11H24N2O3S/c1-3-7-12(8-4-2)17(15,16)13-9-5-6-11(13)10-14/h11,14H,3-10H2,1-2H3
InChIKeyHGGHGWUESFFYFY-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.81
Rot. Bonds7

About 2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide

2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide (PubChem CID 61408971) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is 2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide.

Molecular Properties

Compound Name2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide
PubChem CID61408971
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC Name2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide
SMILESCCCN(CCC)S(=O)(=O)N1CCCC1CO
InChIInChI=1S/C11H24N2O3S/c1-3-7-12(8-4-2)17(15,16)13-9-5-6-11(13)10-14/h11,14H,3-10H2,1-2H3
InChIKeyHGGHGWUESFFYFY-UHFFFAOYSA-N
XLogP0.81
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide?
The IUPAC name of 2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide (CID 61408971) is 2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide.
What is the SMILES notation for 2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide?
The canonical SMILES for 2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide is CCCN(CCC)S(=O)(=O)N1CCCC1CO.
What is the InChIKey of 2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide?
The InChIKey is HGGHGWUESFFYFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-3-7-12(8-4-2)17(15,16)13-9-5-6-11(13)10-14/h11,14H,3-10H2,1-2H3.
What are the key properties of 2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide?
2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide has a molecular weight of 264.39 g/mol, XLogP of 0.81, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(hydroxymethyl)-N,N-dipropylpyrrolidine-1-sulfonamide is sourced from PubChem (CID 61408971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).