1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide

C7H15NO2S — CID 165442883

IUPAC1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide
SMILESCCC1(CS(=O)(=O)NC)CC1
InChIInChI=1S/C7H15NO2S/c1-3-7(4-5-7)6-11(9,10)8-2/h8H,3-6H2,1-2H3
InChIKeyCCEYROMBRDQKSS-UHFFFAOYSA-N
MW177.27 g/mol
LogP0.73
Rot. Bonds4

About 1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide

1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide (PubChem CID 165442883) has the molecular formula C7H15NO2S and a molecular weight of 177.27 g/mol. Its IUPAC name is 1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide.

Molecular Properties

Compound Name1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide
PubChem CID165442883
Molecular FormulaC7H15NO2S
Molecular Weight177.27 g/mol
Exact Mass177.08
IUPAC Name1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide
SMILESCCC1(CS(=O)(=O)NC)CC1
InChIInChI=1S/C7H15NO2S/c1-3-7(4-5-7)6-11(9,10)8-2/h8H,3-6H2,1-2H3
InChIKeyCCEYROMBRDQKSS-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 1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide?
The IUPAC name of 1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide (CID 165442883) is 1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide.
What is the SMILES notation for 1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide?
The canonical SMILES for 1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide is CCC1(CS(=O)(=O)NC)CC1.
What is the InChIKey of 1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide?
The InChIKey is CCEYROMBRDQKSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2S/c1-3-7(4-5-7)6-11(9,10)8-2/h8H,3-6H2,1-2H3.
What are the key properties of 1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide?
1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide 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 1-(1-ethylcyclopropyl)-N-methylmethanesulfonamide is sourced from PubChem (CID 165442883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).