2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide

C14H24N2O3S — CID 128558161

IUPAC2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide
SMILESCS(=O)(=O)N1CCC[C@@H]1CNC(=O)CC1CCC2CC12
InChIInChI=1S/C14H24N2O3S/c1-20(18,19)16-6-2-3-12(16)9-15-14(17)8-11-5-4-10-7-13(10)11/h10-13H,2-9H2,1H3,(H,15,17)/t10?,11?,12-,13?/m1/s1
InChIKeyHNFMHSSTIIVBIS-AYNROABZSA-N
MW300.42 g/mol
LogP0.96
Rot. Bonds5

About 2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide

2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide (PubChem CID 128558161) has the molecular formula C14H24N2O3S and a molecular weight of 300.42 g/mol. Its IUPAC name is 2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide.

Molecular Properties

Compound Name2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide
PubChem CID128558161
Molecular FormulaC14H24N2O3S
Molecular Weight300.42 g/mol
Exact Mass300.15
IUPAC Name2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide
SMILESCS(=O)(=O)N1CCC[C@@H]1CNC(=O)CC1CCC2CC12
InChIInChI=1S/C14H24N2O3S/c1-20(18,19)16-6-2-3-12(16)9-15-14(17)8-11-5-4-10-7-13(10)11/h10-13H,2-9H2,1H3,(H,15,17)/t10?,11?,12-,13?/m1/s1
InChIKeyHNFMHSSTIIVBIS-AYNROABZSA-N
XLogP0.96
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.42
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide 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-[(1-methylsulfonylpyrrolidin-2-yl)methyl]pentanamide
CID 110750211
N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]prop-2-enamide
CID 146127051
1-tert-butyl-3-[(1-methylsulfonylpyrrolidin-2-yl)methyl]urea
CID 110749992
N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]-4-phenoxybutanamide
CID 110750055
tert-butyl N-[(1-methylsulfonylpiperidin-2-yl)methyl]carbamate
CID 59478990
N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]-5-oxopyrrolidine-2-carboxamide
CID 110750058
1-(2,3-dihydro-1H-inden-2-yl)-3-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]urea
CID 122142432
2-(1-methylsulfonylazetidin-2-yl)acetohydrazide
CID 84675189
1,1-difluoro-2-methyl-3-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methylamino]propan-2-ol
CID 138017490
1-methylsulfonyl-2-propylpyrrolidine
CID 59852648
N-[(1-ethylsulfonylpyrrolidin-2-yl)methyl]prop-2-ynamide
CID 146100743
3,4-dimethoxy-N-[(1-methylsulfonylpyrrolidin-2-yl)methyl]benzamide
CID 110750237

Frequently Asked Questions

What is the IUPAC name of 2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide?
The IUPAC name of 2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide (CID 128558161) is 2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide.
What is the SMILES notation for 2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide?
The canonical SMILES for 2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide is CS(=O)(=O)N1CCC[C@@H]1CNC(=O)CC1CCC2CC12.
What is the InChIKey of 2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide?
The InChIKey is HNFMHSSTIIVBIS-AYNROABZSA-N. The full InChI is InChI=1S/C14H24N2O3S/c1-20(18,19)16-6-2-3-12(16)9-15-14(17)8-11-5-4-10-7-13(10)11/h10-13H,2-9H2,1H3,(H,15,17)/t10?,11?,12-,13?/m1/s1.
What are the key properties of 2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide?
2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide has a molecular weight of 300.42 g/mol, XLogP of 0.96, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bicyclo[3.1.0]hexanyl)-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]acetamide is sourced from PubChem (CID 128558161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).