N-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide

C7H15NO2S — CID 121481050

IUPACN-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide
SMILESCC1CC1CCNS(C)(=O)=O
InChIInChI=1S/C7H15NO2S/c1-6-5-7(6)3-4-8-11(2,9)10/h6-8H,3-5H2,1-2H3
InChIKeyJHPRWOGIYKEAOR-UHFFFAOYSA-N
MW177.27 g/mol
LogP0.58
Rot. Bonds4

About N-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide

N-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide (PubChem CID 121481050) has the molecular formula C7H15NO2S and a molecular weight of 177.27 g/mol. Its IUPAC name is N-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide
PubChem CID121481050
Molecular FormulaC7H15NO2S
Molecular Weight177.27 g/mol
Exact Mass177.08
IUPAC NameN-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide
SMILESCC1CC1CCNS(C)(=O)=O
InChIInChI=1S/C7H15NO2S/c1-6-5-7(6)3-4-8-11(2,9)10/h6-8H,3-5H2,1-2H3
InChIKeyJHPRWOGIYKEAOR-UHFFFAOYSA-N
XLogP0.58
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.27
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide?
The IUPAC name of N-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide (CID 121481050) is N-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide.
What is the SMILES notation for N-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide?
The canonical SMILES for N-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide is CC1CC1CCNS(C)(=O)=O.
What is the InChIKey of N-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide?
The InChIKey is JHPRWOGIYKEAOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2S/c1-6-5-7(6)3-4-8-11(2,9)10/h6-8H,3-5H2,1-2H3.
What are the key properties of N-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide?
N-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide has a molecular weight of 177.27 g/mol, XLogP of 0.58, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylcyclopropyl)ethyl]methanesulfonamide is sourced from PubChem (CID 121481050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).