N-[(1-ethylcyclopropyl)methyl]methanesulfonamide

C7H15NO2S — CID 103737576

IUPACN-[(1-ethylcyclopropyl)methyl]methanesulfonamide
SMILESCCC1(CNS(C)(=O)=O)CC1
InChIInChI=1S/C7H15NO2S/c1-3-7(4-5-7)6-8-11(2,9)10/h8H,3-6H2,1-2H3
InChIKeyWZOKHZJFEIKXNC-UHFFFAOYSA-N
MW177.27 g/mol
LogP0.73
Rot. Bonds4

About N-[(1-ethylcyclopropyl)methyl]methanesulfonamide

N-[(1-ethylcyclopropyl)methyl]methanesulfonamide (PubChem CID 103737576) has the molecular formula C7H15NO2S and a molecular weight of 177.27 g/mol. Its IUPAC name is N-[(1-ethylcyclopropyl)methyl]methanesulfonamide.

Molecular Properties

Compound NameN-[(1-ethylcyclopropyl)methyl]methanesulfonamide
PubChem CID103737576
Molecular FormulaC7H15NO2S
Molecular Weight177.27 g/mol
Exact Mass177.08
IUPAC NameN-[(1-ethylcyclopropyl)methyl]methanesulfonamide
SMILESCCC1(CNS(C)(=O)=O)CC1
InChIInChI=1S/C7H15NO2S/c1-3-7(4-5-7)6-8-11(2,9)10/h8H,3-6H2,1-2H3
InChIKeyWZOKHZJFEIKXNC-UHFFFAOYSA-N
XLogP0.73
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 ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylcyclopropyl)methyl]methanesulfonamide?
The IUPAC name of N-[(1-ethylcyclopropyl)methyl]methanesulfonamide (CID 103737576) is N-[(1-ethylcyclopropyl)methyl]methanesulfonamide.
What is the SMILES notation for N-[(1-ethylcyclopropyl)methyl]methanesulfonamide?
The canonical SMILES for N-[(1-ethylcyclopropyl)methyl]methanesulfonamide is CCC1(CNS(C)(=O)=O)CC1.
What is the InChIKey of N-[(1-ethylcyclopropyl)methyl]methanesulfonamide?
The InChIKey is WZOKHZJFEIKXNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2S/c1-3-7(4-5-7)6-8-11(2,9)10/h8H,3-6H2,1-2H3.
What are the key properties of N-[(1-ethylcyclopropyl)methyl]methanesulfonamide?
N-[(1-ethylcyclopropyl)methyl]methanesulfonamide has a molecular weight of 177.27 g/mol, XLogP of 0.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylcyclopropyl)methyl]methanesulfonamide is sourced from PubChem (CID 103737576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).