N-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide

C11H21N3O3S — CID 103794357

IUPACN-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide
SMILESCS(=O)(=O)NC1CCN(C(=O)[C@H]2CCCN2)CC1
InChIInChI=1S/C11H21N3O3S/c1-18(16,17)13-9-4-7-14(8-5-9)11(15)10-3-2-6-12-10/h9-10,12-13H,2-8H2,1H3/t10-/m1/s1
InChIKeyOIHWFHPSZVXWOR-SNVBAGLBSA-N
MW275.37 g/mol
LogP-0.72
Rot. Bonds3

About N-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide

N-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide (PubChem CID 103794357) has the molecular formula C11H21N3O3S and a molecular weight of 275.37 g/mol. Its IUPAC name is N-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide
PubChem CID103794357
Molecular FormulaC11H21N3O3S
Molecular Weight275.37 g/mol
Exact Mass275.13
IUPAC NameN-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide
SMILESCS(=O)(=O)NC1CCN(C(=O)[C@H]2CCCN2)CC1
InChIInChI=1S/C11H21N3O3S/c1-18(16,17)13-9-4-7-14(8-5-9)11(15)10-3-2-6-12-10/h9-10,12-13H,2-8H2,1H3/t10-/m1/s1
InChIKeyOIHWFHPSZVXWOR-SNVBAGLBSA-N
XLogP-0.72
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 5-0.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]benzenesulfonamide;hydrochloride
CID 119276101
pyrrolidin-1-yl(pyrrolidin-2-yl)methanone
CID 550904
N-[1-(cyclohexanecarbonyl)piperidin-4-yl]methanesulfonamide
CID 51302071
N-[1-[(2S)-piperidine-2-carbonyl]piperidin-4-yl]acetamide
CID 103810108
(4-aminopiperidin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone
CID 131224010
(4-methylpiperazin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone;dihydrochloride
CID 165429624
(4-aminopiperidin-1-yl)-pyrrolidin-2-ylmethanone
CID 110461351
(4-propan-2-ylpiperidin-1-yl)-pyrrolidin-2-ylmethanone;hydrochloride
CID 119336352
N-methyl-N-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]ethanesulfonamide
CID 119322028
1-[4-[(2S)-pyrrolidine-2-carbonyl]-1,4-diazepan-1-yl]ethanone
CID 55002826
(3-methylpyrrolidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone
CID 103795857
[4-[(1R)-1-hydroxyethyl]piperidin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone
CID 129412705

Frequently Asked Questions

What is the IUPAC name of N-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide?
The IUPAC name of N-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide (CID 103794357) is N-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide.
What is the SMILES notation for N-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide?
The canonical SMILES for N-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide is CS(=O)(=O)NC1CCN(C(=O)[C@H]2CCCN2)CC1.
What is the InChIKey of N-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide?
The InChIKey is OIHWFHPSZVXWOR-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H21N3O3S/c1-18(16,17)13-9-4-7-14(8-5-9)11(15)10-3-2-6-12-10/h9-10,12-13H,2-8H2,1H3/t10-/m1/s1.
What are the key properties of N-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide?
N-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide has a molecular weight of 275.37 g/mol, XLogP of -0.72, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(2R)-pyrrolidine-2-carbonyl]piperidin-4-yl]methanesulfonamide is sourced from PubChem (CID 103794357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).