N-cyclopropyl-N-ethylpropane-1-sulfonamide

C8H17NO2S — CID 61383718

IUPACN-cyclopropyl-N-ethylpropane-1-sulfonamide
SMILESCCCS(=O)(=O)N(CC)C1CC1
InChIInChI=1S/C8H17NO2S/c1-3-7-12(10,11)9(4-2)8-5-6-8/h8H,3-7H2,1-2H3
InChIKeyQMUWJRBIMAMKCI-UHFFFAOYSA-N
MW191.30 g/mol
LogP1.21
Rot. Bonds5

About N-cyclopropyl-N-ethylpropane-1-sulfonamide

N-cyclopropyl-N-ethylpropane-1-sulfonamide (PubChem CID 61383718) has the molecular formula C8H17NO2S and a molecular weight of 191.30 g/mol. Its IUPAC name is N-cyclopropyl-N-ethylpropane-1-sulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-N-ethylpropane-1-sulfonamide
PubChem CID61383718
Molecular FormulaC8H17NO2S
Molecular Weight191.30 g/mol
Exact Mass191.10
IUPAC NameN-cyclopropyl-N-ethylpropane-1-sulfonamide
SMILESCCCS(=O)(=O)N(CC)C1CC1
InChIInChI=1S/C8H17NO2S/c1-3-7-12(10,11)9(4-2)8-5-6-8/h8H,3-7H2,1-2H3
InChIKeyQMUWJRBIMAMKCI-UHFFFAOYSA-N
XLogP1.21
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.30
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-ethylpropane-1-sulfonamide?
The IUPAC name of N-cyclopropyl-N-ethylpropane-1-sulfonamide (CID 61383718) is N-cyclopropyl-N-ethylpropane-1-sulfonamide.
What is the SMILES notation for N-cyclopropyl-N-ethylpropane-1-sulfonamide?
The canonical SMILES for N-cyclopropyl-N-ethylpropane-1-sulfonamide is CCCS(=O)(=O)N(CC)C1CC1.
What is the InChIKey of N-cyclopropyl-N-ethylpropane-1-sulfonamide?
The InChIKey is QMUWJRBIMAMKCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2S/c1-3-7-12(10,11)9(4-2)8-5-6-8/h8H,3-7H2,1-2H3.
What are the key properties of N-cyclopropyl-N-ethylpropane-1-sulfonamide?
N-cyclopropyl-N-ethylpropane-1-sulfonamide has a molecular weight of 191.30 g/mol, XLogP of 1.21, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-ethylpropane-1-sulfonamide is sourced from PubChem (CID 61383718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).