N-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide

C11H15NO2S — CID 94197122

IUPACN-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide
SMILESCS(=O)(=O)N[C@H](c1ccccc1)C1CC1
InChIInChI=1S/C11H15NO2S/c1-15(13,14)12-11(10-7-8-10)9-5-3-2-4-6-9/h2-6,10-12H,7-8H2,1H3/t11-/m1/s1
InChIKeyDKAYOYKXXBQVGA-LLVKDONJSA-N
MW225.31 g/mol
LogP1.69
Rot. Bonds4

About N-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide

N-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide (PubChem CID 94197122) has the molecular formula C11H15NO2S and a molecular weight of 225.31 g/mol. Its IUPAC name is N-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide.

Molecular Properties

Compound NameN-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide
PubChem CID94197122
Molecular FormulaC11H15NO2S
Molecular Weight225.31 g/mol
Exact Mass225.08
IUPAC NameN-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide
SMILESCS(=O)(=O)N[C@H](c1ccccc1)C1CC1
InChIInChI=1S/C11H15NO2S/c1-15(13,14)12-11(10-7-8-10)9-5-3-2-4-6-9/h2-6,10-12H,7-8H2,1H3/t11-/m1/s1
InChIKeyDKAYOYKXXBQVGA-LLVKDONJSA-N
XLogP1.69
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.31
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(S)-cyclopropyl(phenyl)methyl]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

1-cyclopropyl-N-[cyclopropyl(phenyl)methyl]-1-phenylmethanamine
CID 61312190
3-[[cyclopropyl(phenyl)methyl]sulfamoyl]propanoic acid
CID 43361844
N-[cyclopropyl(phenyl)methyl]-1-ethylsulfonylpropan-2-amine
CID 115898623
3-bromo-N-[cyclopropyl(phenyl)methyl]thiophene-2-sulfonamide
CID 61074037
N-[cyclopropyl(phenyl)methyl]-3-methylsulfonylaniline
CID 61313567
3-chloro-N-[(S)-cyclopropyl(phenyl)methyl]benzenesulfonamide
CID 30037407
4-chloro-N-[cyclopropyl(phenyl)methyl]-2-nitrobenzenesulfonamide
CID 55565443
[cyclopropyl(phenyl)methyl]hydrazine
CID 53403097
5-bromo-N-[cyclopropyl(phenyl)methyl]-4-methylthiophene-2-sulfonamide
CID 79998796
N-[2-[[cyclopropyl(phenyl)methyl]amino]ethyl]-2-methylpropanamide
CID 61313757
N-[(S)-cyclopropyl(phenyl)methyl]-6-nitropyridine-3-sulfonamide
CID 95342733
3-bromo-N-[cyclopropyl(phenyl)methyl]-4-methoxybenzenesulfonamide
CID 24679031

Frequently Asked Questions

What is the IUPAC name of N-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide?
The IUPAC name of N-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide (CID 94197122) is N-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide.
What is the SMILES notation for N-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide?
The canonical SMILES for N-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide is CS(=O)(=O)N[C@H](c1ccccc1)C1CC1.
What is the InChIKey of N-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide?
The InChIKey is DKAYOYKXXBQVGA-LLVKDONJSA-N. The full InChI is InChI=1S/C11H15NO2S/c1-15(13,14)12-11(10-7-8-10)9-5-3-2-4-6-9/h2-6,10-12H,7-8H2,1H3/t11-/m1/s1.
What are the key properties of N-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide?
N-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide has a molecular weight of 225.31 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(S)-cyclopropyl(phenyl)methyl]methanesulfonamide is sourced from PubChem (CID 94197122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).