N-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide

C12H23N3O3S — CID 102778694

IUPACN-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide
SMILESCC1CCNC1C(=O)N1CCCC(NS(C)(=O)=O)C1
InChIInChI=1S/C12H23N3O3S/c1-9-5-6-13-11(9)12(16)15-7-3-4-10(8-15)14-19(2,17)18/h9-11,13-14H,3-8H2,1-2H3
InChIKeyLWYLVMCWUMHELN-UHFFFAOYSA-N
MW289.40 g/mol
LogP-0.48
Rot. Bonds3

About N-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide

N-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide (PubChem CID 102778694) has the molecular formula C12H23N3O3S and a molecular weight of 289.40 g/mol. Its IUPAC name is N-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide
PubChem CID102778694
Molecular FormulaC12H23N3O3S
Molecular Weight289.40 g/mol
Exact Mass289.15
IUPAC NameN-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide
SMILESCC1CCNC1C(=O)N1CCCC(NS(C)(=O)=O)C1
InChIInChI=1S/C12H23N3O3S/c1-9-5-6-13-11(9)12(16)15-7-3-4-10(8-15)14-19(2,17)18/h9-11,13-14H,3-8H2,1-2H3
InChIKeyLWYLVMCWUMHELN-UHFFFAOYSA-N
XLogP-0.48
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 5-0.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

(3-methylpyrrolidin-2-yl)-pyrrolidin-1-ylmethanone
CID 85176427
N-[(3S)-1-[(4S)-1,3-thiazolidine-4-carbonyl]piperidin-3-yl]methanesulfonamide
CID 93371379
3-[3-(methanesulfonamido)piperidine-1-carbonyl]-2,2-dimethylcyclopropane-1-carboxylic acid
CID 64834840
N-[1-(2,2,2-trifluoroacetyl)piperidin-3-yl]methanesulfonamide
CID 62490631
3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide
CID 51083495
3-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]propanoic acid
CID 102779251
(3R)-1-(3-methylpiperidine-2-carbonyl)piperidine-3-carboxylic acid
CID 107068398
N-[(3R)-1-(cyclopropanecarbonyl)pyrrolidin-3-yl]methanesulfonamide
CID 95051787
N-[(3S)-1-[(2R)-2,3-dihydro-1H-indole-2-carbonyl]piperidin-3-yl]methanesulfonamide
CID 129323229
N-[1-(2H-triazole-4-carbonyl)piperidin-3-yl]methanesulfonamide
CID 113226212
(3-ethylpyrrolidin-1-yl)-(3-methylpyrrolidin-2-yl)methanone
CID 102780010
N-[(3S)-1-(7-fluorobicyclo[4.1.0]heptane-7-carbonyl)piperidin-3-yl]methanesulfonamide
CID 166310642

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide?
The IUPAC name of N-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide (CID 102778694) is N-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide.
What is the SMILES notation for N-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide?
The canonical SMILES for N-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide is CC1CCNC1C(=O)N1CCCC(NS(C)(=O)=O)C1.
What is the InChIKey of N-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide?
The InChIKey is LWYLVMCWUMHELN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O3S/c1-9-5-6-13-11(9)12(16)15-7-3-4-10(8-15)14-19(2,17)18/h9-11,13-14H,3-8H2,1-2H3.
What are the key properties of N-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide?
N-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide has a molecular weight of 289.40 g/mol, XLogP of -0.48, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide is sourced from PubChem (CID 102778694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).