N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide

C9H19N3O2S — CID 62541643

IUPACN-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide
SMILESO=S(=O)(NCC1CCCN1)N1CCCC1
InChIInChI=1S/C9H19N3O2S/c13-15(14,12-6-1-2-7-12)11-8-9-4-3-5-10-9/h9-11H,1-8H2
InChIKeyLXYQOLWCGMSXIL-UHFFFAOYSA-N
MW233.34 g/mol
LogP-0.33
Rot. Bonds4

About N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide

N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide (PubChem CID 62541643) has the molecular formula C9H19N3O2S and a molecular weight of 233.34 g/mol. Its IUPAC name is N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide
PubChem CID62541643
Molecular FormulaC9H19N3O2S
Molecular Weight233.34 g/mol
Exact Mass233.12
IUPAC NameN-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide
SMILESO=S(=O)(NCC1CCCN1)N1CCCC1
InChIInChI=1S/C9H19N3O2S/c13-15(14,12-6-1-2-7-12)11-8-9-4-3-5-10-9/h9-11H,1-8H2
InChIKeyLXYQOLWCGMSXIL-UHFFFAOYSA-N
XLogP-0.33
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide;hydrochloride
CID 119974092
N-[[(2R)-pyrrolidin-2-yl]methyl]azepane-1-sulfonamide
CID 131895046
N-(2-pyrrolidin-2-ylethyl)azepane-1-sulfonamide
CID 114794249
N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 59418450
N-(pyrrolidin-2-ylmethyl)cyclopentanesulfonamide
CID 115752325
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]morpholine-4-sulfonamide;hydrochloride
CID 120723511
1-cyclopentyl-N-[[(2R)-pyrrolidin-2-yl]methyl]methanesulfonamide
CID 121497367
N-[(3,3-dimethylpiperidin-2-yl)methyl]pyrrolidine-1-sulfonamide
CID 114083940
N-[(2-hydroxycyclohexyl)methyl]piperidine-1-sulfonamide
CID 64910982
1-cyclohexyl-N-(pyrrolidin-2-ylmethyl)methanesulfonamide;hydrochloride
CID 119974331
1-(piperidin-2-ylmethylsulfonyl)piperidine
CID 55151116
N-methyl-N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide
CID 106607328

Frequently Asked Questions

What is the IUPAC name of N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide?
The IUPAC name of N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide (CID 62541643) is N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide?
The canonical SMILES for N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide is O=S(=O)(NCC1CCCN1)N1CCCC1.
What is the InChIKey of N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide?
The InChIKey is LXYQOLWCGMSXIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2S/c13-15(14,12-6-1-2-7-12)11-8-9-4-3-5-10-9/h9-11H,1-8H2.
What are the key properties of N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide?
N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide has a molecular weight of 233.34 g/mol, XLogP of -0.33, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyrrolidin-2-ylmethyl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 62541643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).