N-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide

C10H19NO3S — CID 61356526

IUPACN-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide
SMILESCCS(=O)(=O)N(CC1CCOC1)C1CC1
InChIInChI=1S/C10H19NO3S/c1-2-15(12,13)11(10-3-4-10)7-9-5-6-14-8-9/h9-10H,2-8H2,1H3
InChIKeyZNCPDKVYJIOGQX-UHFFFAOYSA-N
MW233.33 g/mol
LogP0.84
Rot. Bonds5

About N-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide

N-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide (PubChem CID 61356526) has the molecular formula C10H19NO3S and a molecular weight of 233.33 g/mol. Its IUPAC name is N-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide
PubChem CID61356526
Molecular FormulaC10H19NO3S
Molecular Weight233.33 g/mol
Exact Mass233.11
IUPAC NameN-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide
SMILESCCS(=O)(=O)N(CC1CCOC1)C1CC1
InChIInChI=1S/C10H19NO3S/c1-2-15(12,13)11(10-3-4-10)7-9-5-6-14-8-9/h9-10H,2-8H2,1H3
InChIKeyZNCPDKVYJIOGQX-UHFFFAOYSA-N
XLogP0.84
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.33
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide?
The IUPAC name of N-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide (CID 61356526) is N-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide.
What is the SMILES notation for N-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide?
The canonical SMILES for N-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide is CCS(=O)(=O)N(CC1CCOC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide?
The InChIKey is ZNCPDKVYJIOGQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3S/c1-2-15(12,13)11(10-3-4-10)7-9-5-6-14-8-9/h9-10H,2-8H2,1H3.
What are the key properties of N-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide?
N-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide has a molecular weight of 233.33 g/mol, XLogP of 0.84, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(oxolan-3-ylmethyl)ethanesulfonamide is sourced from PubChem (CID 61356526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).