N-(3-methylcyclobutyl)methanesulfonamide

C6H13NO2S — CID 58748920

IUPACN-(3-methylcyclobutyl)methanesulfonamide
SMILESCC1CC(NS(C)(=O)=O)C1
InChIInChI=1S/C6H13NO2S/c1-5-3-6(4-5)7-10(2,8)9/h5-7H,3-4H2,1-2H3
InChIKeyGLJJKGQEJZOKEQ-UHFFFAOYSA-N
MW163.24 g/mol
LogP0.33
Rot. Bonds2

About N-(3-methylcyclobutyl)methanesulfonamide

N-(3-methylcyclobutyl)methanesulfonamide (PubChem CID 58748920) has the molecular formula C6H13NO2S and a molecular weight of 163.24 g/mol. Its IUPAC name is N-(3-methylcyclobutyl)methanesulfonamide.

Molecular Properties

Compound NameN-(3-methylcyclobutyl)methanesulfonamide
PubChem CID58748920
Molecular FormulaC6H13NO2S
Molecular Weight163.24 g/mol
Exact Mass163.07
IUPAC NameN-(3-methylcyclobutyl)methanesulfonamide
SMILESCC1CC(NS(C)(=O)=O)C1
InChIInChI=1S/C6H13NO2S/c1-5-3-6(4-5)7-10(2,8)9/h5-7H,3-4H2,1-2H3
InChIKeyGLJJKGQEJZOKEQ-UHFFFAOYSA-N
XLogP0.33
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.24
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(trifluoromethyl)cyclobutyl]methanesulfonamide
CID 130662657
N-[3-(trifluoromethyl)cyclobutyl]methanesulfonamide
CID 131182838
N-(2,4-dimethylpentan-3-yl)methanesulfonamide
CID 1280652
N-(3-methylbutyl)methanesulfonamide
CID 3906059
N-pentan-2-ylmethanesulfonamide
CID 4469405
N-(4-methylpentan-2-yl)methanesulfonamide
CID 23198459
N-(2-ethylcyclopropyl)methanesulfonamide
CID 56978398
N-(cyclobutylmethyl)ethanesulfonamide
CID 57257592
N-[(2R)-4-methylpentan-2-yl]methanesulfonamide
CID 57846726
N-[(2R)-3-methylbutan-2-yl]methanesulfonamide
CID 58679592
N-cyclobutylmethanesulfonamide
CID 58961389
N-(3-methylbutan-2-yl)methanesulfonamide
CID 59687732

Frequently Asked Questions

What is the IUPAC name of N-(3-methylcyclobutyl)methanesulfonamide?
The IUPAC name of N-(3-methylcyclobutyl)methanesulfonamide (CID 58748920) is N-(3-methylcyclobutyl)methanesulfonamide.
What is the SMILES notation for N-(3-methylcyclobutyl)methanesulfonamide?
The canonical SMILES for N-(3-methylcyclobutyl)methanesulfonamide is CC1CC(NS(C)(=O)=O)C1.
What is the InChIKey of N-(3-methylcyclobutyl)methanesulfonamide?
The InChIKey is GLJJKGQEJZOKEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2S/c1-5-3-6(4-5)7-10(2,8)9/h5-7H,3-4H2,1-2H3.
What are the key properties of N-(3-methylcyclobutyl)methanesulfonamide?
N-(3-methylcyclobutyl)methanesulfonamide has a molecular weight of 163.24 g/mol, XLogP of 0.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylcyclobutyl)methanesulfonamide is sourced from PubChem (CID 58748920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).