N-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide

C11H24N2O3S — CID 65420490

IUPACN-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide
SMILESCCC(CC)N(CCO)S(=O)(=O)C1CCNC1
InChIInChI=1S/C11H24N2O3S/c1-3-10(4-2)13(7-8-14)17(15,16)11-5-6-12-9-11/h10-12,14H,3-9H2,1-2H3
InChIKeyCGZQOPFKSCVISX-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.16
Rot. Bonds7

About N-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide

N-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide (PubChem CID 65420490) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide
PubChem CID65420490
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC NameN-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide
SMILESCCC(CC)N(CCO)S(=O)(=O)C1CCNC1
InChIInChI=1S/C11H24N2O3S/c1-3-10(4-2)13(7-8-14)17(15,16)11-5-6-12-9-11/h10-12,14H,3-9H2,1-2H3
InChIKeyCGZQOPFKSCVISX-UHFFFAOYSA-N
XLogP0.16
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide?
The IUPAC name of N-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide (CID 65420490) is N-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide is CCC(CC)N(CCO)S(=O)(=O)C1CCNC1.
What is the InChIKey of N-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide?
The InChIKey is CGZQOPFKSCVISX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-3-10(4-2)13(7-8-14)17(15,16)11-5-6-12-9-11/h10-12,14H,3-9H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide?
N-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide has a molecular weight of 264.39 g/mol, XLogP of 0.16, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide is sourced from PubChem (CID 65420490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).