N-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide

C10H21NO2S — CID 58946011

IUPACN-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide
SMILESCN(C1CC(C(C)(C)C)C1)S(C)(=O)=O
InChIInChI=1S/C10H21NO2S/c1-10(2,3)8-6-9(7-8)11(4)14(5,12)13/h8-9H,6-7H2,1-5H3
InChIKeyRSAMCOOIKCXGLL-UHFFFAOYSA-N
MW219.35 g/mol
LogP1.70
Rot. Bonds2

About N-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide

N-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide (PubChem CID 58946011) has the molecular formula C10H21NO2S and a molecular weight of 219.35 g/mol. Its IUPAC name is N-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide.

Molecular Properties

Compound NameN-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide
PubChem CID58946011
Molecular FormulaC10H21NO2S
Molecular Weight219.35 g/mol
Exact Mass219.13
IUPAC NameN-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide
SMILESCN(C1CC(C(C)(C)C)C1)S(C)(=O)=O
InChIInChI=1S/C10H21NO2S/c1-10(2,3)8-6-9(7-8)11(4)14(5,12)13/h8-9H,6-7H2,1-5H3
InChIKeyRSAMCOOIKCXGLL-UHFFFAOYSA-N
XLogP1.70
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.35
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide?
The IUPAC name of N-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide (CID 58946011) is N-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide.
What is the SMILES notation for N-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide?
The canonical SMILES for N-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide is CN(C1CC(C(C)(C)C)C1)S(C)(=O)=O.
What is the InChIKey of N-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide?
The InChIKey is RSAMCOOIKCXGLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2S/c1-10(2,3)8-6-9(7-8)11(4)14(5,12)13/h8-9H,6-7H2,1-5H3.
What are the key properties of N-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide?
N-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide has a molecular weight of 219.35 g/mol, XLogP of 1.70, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-tert-butylcyclobutyl)-N-methylmethanesulfonamide is sourced from PubChem (CID 58946011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).