N-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide

C12H22N2O2S — CID 54971959

IUPACN-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide
SMILESO=S(=O)(CC1CCCN1)NC(C1CC1)C1CC1
InChIInChI=1S/C12H22N2O2S/c15-17(16,8-11-2-1-7-13-11)14-12(9-3-4-9)10-5-6-10/h9-14H,1-8H2
InChIKeyHNBARUMENKHRKL-UHFFFAOYSA-N
MW258.39 g/mol
LogP0.85
Rot. Bonds6

About N-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide

N-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide (PubChem CID 54971959) has the molecular formula C12H22N2O2S and a molecular weight of 258.39 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide
PubChem CID54971959
Molecular FormulaC12H22N2O2S
Molecular Weight258.39 g/mol
Exact Mass258.14
IUPAC NameN-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide
SMILESO=S(=O)(CC1CCCN1)NC(C1CC1)C1CC1
InChIInChI=1S/C12H22N2O2S/c15-17(16,8-11-2-1-7-13-11)14-12(9-3-4-9)10-5-6-10/h9-14H,1-8H2
InChIKeyHNBARUMENKHRKL-UHFFFAOYSA-N
XLogP0.85
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.39
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide?
The IUPAC name of N-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide (CID 54971959) is N-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide.
What is the SMILES notation for N-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide?
The canonical SMILES for N-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide is O=S(=O)(CC1CCCN1)NC(C1CC1)C1CC1.
What is the InChIKey of N-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide?
The InChIKey is HNBARUMENKHRKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2S/c15-17(16,8-11-2-1-7-13-11)14-12(9-3-4-9)10-5-6-10/h9-14H,1-8H2.
What are the key properties of N-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide?
N-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide has a molecular weight of 258.39 g/mol, XLogP of 0.85, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-1-pyrrolidin-2-ylmethanesulfonamide is sourced from PubChem (CID 54971959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).