N-(2-hydroxypropyl)pyrrolidine-1-sulfonamide

C7H16N2O3S — CID 43502415

IUPACN-(2-hydroxypropyl)pyrrolidine-1-sulfonamide
SMILESCC(O)CNS(=O)(=O)N1CCCC1
InChIInChI=1S/C7H16N2O3S/c1-7(10)6-8-13(11,12)9-4-2-3-5-9/h7-8,10H,2-6H2,1H3
InChIKeyVUGZWIUUUZVKDM-UHFFFAOYSA-N
MW208.28 g/mol
LogP-0.70
Rot. Bonds4

About N-(2-hydroxypropyl)pyrrolidine-1-sulfonamide

N-(2-hydroxypropyl)pyrrolidine-1-sulfonamide (PubChem CID 43502415) has the molecular formula C7H16N2O3S and a molecular weight of 208.28 g/mol. Its IUPAC name is N-(2-hydroxypropyl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)pyrrolidine-1-sulfonamide
PubChem CID43502415
Molecular FormulaC7H16N2O3S
Molecular Weight208.28 g/mol
Exact Mass208.09
IUPAC NameN-(2-hydroxypropyl)pyrrolidine-1-sulfonamide
SMILESCC(O)CNS(=O)(=O)N1CCCC1
InChIInChI=1S/C7H16N2O3S/c1-7(10)6-8-13(11,12)9-4-2-3-5-9/h7-8,10H,2-6H2,1H3
InChIKeyVUGZWIUUUZVKDM-UHFFFAOYSA-N
XLogP-0.70
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 5-0.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)pyrrolidine-1-sulfonamide?
The IUPAC name of N-(2-hydroxypropyl)pyrrolidine-1-sulfonamide (CID 43502415) is N-(2-hydroxypropyl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for N-(2-hydroxypropyl)pyrrolidine-1-sulfonamide?
The canonical SMILES for N-(2-hydroxypropyl)pyrrolidine-1-sulfonamide is CC(O)CNS(=O)(=O)N1CCCC1.
What is the InChIKey of N-(2-hydroxypropyl)pyrrolidine-1-sulfonamide?
The InChIKey is VUGZWIUUUZVKDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O3S/c1-7(10)6-8-13(11,12)9-4-2-3-5-9/h7-8,10H,2-6H2,1H3.
What are the key properties of N-(2-hydroxypropyl)pyrrolidine-1-sulfonamide?
N-(2-hydroxypropyl)pyrrolidine-1-sulfonamide has a molecular weight of 208.28 g/mol, XLogP of -0.70, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 43502415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).