N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide

C11H22N2O3S — CID 110750211

IUPACN-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide
SMILESCCCCC(=O)NCC1CCCN1S(C)(=O)=O
InChIInChI=1S/C11H22N2O3S/c1-3-4-7-11(14)12-9-10-6-5-8-13(10)17(2,15)16/h10H,3-9H2,1-2H3,(H,12,14)
InChIKeyAQMPEKCTNZJUNS-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.72
Rot. Bonds6

About N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide

N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide (PubChem CID 110750211) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide.

Molecular Properties

Compound NameN-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide
PubChem CID110750211
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC NameN-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide
SMILESCCCCC(=O)NCC1CCCN1S(C)(=O)=O
InChIInChI=1S/C11H22N2O3S/c1-3-4-7-11(14)12-9-10-6-5-8-13(10)17(2,15)16/h10H,3-9H2,1-2H3,(H,12,14)
InChIKeyAQMPEKCTNZJUNS-UHFFFAOYSA-N
XLogP0.72
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide 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

N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]prop-2-enamide
CID 146127051
N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]-4-phenoxybutanamide
CID 110750055
2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide
CID 128558161
1-tert-butyl-3-[(1-methylsulfonylpyrrolidin-2-yl)methyl]urea
CID 110749992
1-methylsulfonyl-2-propylpyrrolidine
CID 59852648
tert-butyl N-[(1-methylsulfonylpiperidin-2-yl)methyl]carbamate
CID 59478990
N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]-5-oxopyrrolidine-2-carboxamide
CID 110750058
3-amino-N-[[1-[ethyl(methyl)sulfamoyl]piperidin-2-yl]methyl]propanamide
CID 120584445
4-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]butanamide
CID 106019327
(2R)-N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-1-methylsulfonylpiperidine-2-carboxamide
CID 124831536
1-(2,3-dihydro-1H-inden-2-yl)-3-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]urea
CID 122142432
N-[(1-acetylpiperidin-4-yl)methyl]pentanamide
CID 110736125

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide?
The IUPAC name of N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide (CID 110750211) is N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide.
What is the SMILES notation for N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide?
The canonical SMILES for N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide is CCCCC(=O)NCC1CCCN1S(C)(=O)=O.
What is the InChIKey of N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide?
The InChIKey is AQMPEKCTNZJUNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-3-4-7-11(14)12-9-10-6-5-8-13(10)17(2,15)16/h10H,3-9H2,1-2H3,(H,12,14).
What are the key properties of N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide?
N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide has a molecular weight of 262.37 g/mol, XLogP of 0.72, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide is sourced from PubChem (CID 110750211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).