N-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide

C8H17NO3S — CID 43577530

IUPACN-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)N(CCO)C1CC1
InChIInChI=1S/C8H17NO3S/c1-2-7-13(11,12)9(5-6-10)8-3-4-8/h8,10H,2-7H2,1H3
InChIKeyYOSCZSZOKWZLSC-UHFFFAOYSA-N
MW207.29 g/mol
LogP0.18
Rot. Bonds6

About N-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide

N-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide (PubChem CID 43577530) has the molecular formula C8H17NO3S and a molecular weight of 207.29 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide
PubChem CID43577530
Molecular FormulaC8H17NO3S
Molecular Weight207.29 g/mol
Exact Mass207.09
IUPAC NameN-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)N(CCO)C1CC1
InChIInChI=1S/C8H17NO3S/c1-2-7-13(11,12)9(5-6-10)8-3-4-8/h8,10H,2-7H2,1H3
InChIKeyYOSCZSZOKWZLSC-UHFFFAOYSA-N
XLogP0.18
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide?
The IUPAC name of N-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide (CID 43577530) is N-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide.
What is the SMILES notation for N-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide?
The canonical SMILES for N-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide is CCCS(=O)(=O)N(CCO)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide?
The InChIKey is YOSCZSZOKWZLSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO3S/c1-2-7-13(11,12)9(5-6-10)8-3-4-8/h8,10H,2-7H2,1H3.
What are the key properties of N-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide?
N-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide has a molecular weight of 207.29 g/mol, XLogP of 0.18, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-hydroxyethyl)propane-1-sulfonamide is sourced from PubChem (CID 43577530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).