N-(3-tert-butylcyclobutyl)methanesulfonamide

C9H19NO2S — CID 58945987

IUPACN-(3-tert-butylcyclobutyl)methanesulfonamide
SMILESCC(C)(C)C1CC(NS(C)(=O)=O)C1
InChIInChI=1S/C9H19NO2S/c1-9(2,3)7-5-8(6-7)10-13(4,11)12/h7-8,10H,5-6H2,1-4H3
InChIKeyFMSNMPHDVSKZGF-UHFFFAOYSA-N
MW205.32 g/mol
LogP1.36
Rot. Bonds2

About N-(3-tert-butylcyclobutyl)methanesulfonamide

N-(3-tert-butylcyclobutyl)methanesulfonamide (PubChem CID 58945987) has the molecular formula C9H19NO2S and a molecular weight of 205.32 g/mol. Its IUPAC name is N-(3-tert-butylcyclobutyl)methanesulfonamide.

Molecular Properties

Compound NameN-(3-tert-butylcyclobutyl)methanesulfonamide
PubChem CID58945987
Molecular FormulaC9H19NO2S
Molecular Weight205.32 g/mol
Exact Mass205.11
IUPAC NameN-(3-tert-butylcyclobutyl)methanesulfonamide
SMILESCC(C)(C)C1CC(NS(C)(=O)=O)C1
InChIInChI=1S/C9H19NO2S/c1-9(2,3)7-5-8(6-7)10-13(4,11)12/h7-8,10H,5-6H2,1-4H3
InChIKeyFMSNMPHDVSKZGF-UHFFFAOYSA-N
XLogP1.36
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.32
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-tert-butylcyclobutyl)methanesulfonamide?
The IUPAC name of N-(3-tert-butylcyclobutyl)methanesulfonamide (CID 58945987) is N-(3-tert-butylcyclobutyl)methanesulfonamide.
What is the SMILES notation for N-(3-tert-butylcyclobutyl)methanesulfonamide?
The canonical SMILES for N-(3-tert-butylcyclobutyl)methanesulfonamide is CC(C)(C)C1CC(NS(C)(=O)=O)C1.
What is the InChIKey of N-(3-tert-butylcyclobutyl)methanesulfonamide?
The InChIKey is FMSNMPHDVSKZGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2S/c1-9(2,3)7-5-8(6-7)10-13(4,11)12/h7-8,10H,5-6H2,1-4H3.
What are the key properties of N-(3-tert-butylcyclobutyl)methanesulfonamide?
N-(3-tert-butylcyclobutyl)methanesulfonamide has a molecular weight of 205.32 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-tert-butylcyclobutyl)methanesulfonamide is sourced from PubChem (CID 58945987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).