N-cyclopropyl-N-(oxolan-3-ylmethyl)propane-2-sulfonamide

C11H21NO3S — CID 61356525

IUPACN-cyclopropyl-N-(oxolan-3-ylmethyl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)N(CC1CCOC1)C1CC1
InChIInChI=1S/C11H21NO3S/c1-9(2)16(13,14)12(11-3-4-11)7-10-5-6-15-8-10/h9-11H,3-8H2,1-2H3
InChIKeyBZWBUFQYWOAYGO-UHFFFAOYSA-N
MW247.36 g/mol
LogP1.23
Rot. Bonds5

About N-cyclopropyl-N-(oxolan-3-ylmethyl)propane-2-sulfonamide

N-cyclopropyl-N-(oxolan-3-ylmethyl)propane-2-sulfonamide (PubChem CID 61356525) has the molecular formula C11H21NO3S and a molecular weight of 247.36 g/mol. Its IUPAC name is N-cyclopropyl-N-(oxolan-3-ylmethyl)propane-2-sulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(oxolan-3-ylmethyl)propane-2-sulfonamide
PubChem CID61356525
Molecular FormulaC11H21NO3S
Molecular Weight247.36 g/mol
Exact Mass247.12
IUPAC NameN-cyclopropyl-N-(oxolan-3-ylmethyl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)N(CC1CCOC1)C1CC1
InChIInChI=1S/C11H21NO3S/c1-9(2)16(13,14)12(11-3-4-11)7-10-5-6-15-8-10/h9-11H,3-8H2,1-2H3
InChIKeyBZWBUFQYWOAYGO-UHFFFAOYSA-N
XLogP1.23
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 51.23
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)propane-2-sulfonamide?
The IUPAC name of N-cyclopropyl-N-(oxolan-3-ylmethyl)propane-2-sulfonamide (CID 61356525) is N-cyclopropyl-N-(oxolan-3-ylmethyl)propane-2-sulfonamide.
What is the SMILES notation for N-cyclopropyl-N-(oxolan-3-ylmethyl)propane-2-sulfonamide?
The canonical SMILES for N-cyclopropyl-N-(oxolan-3-ylmethyl)propane-2-sulfonamide is CC(C)S(=O)(=O)N(CC1CCOC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(oxolan-3-ylmethyl)propane-2-sulfonamide?
The InChIKey is BZWBUFQYWOAYGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3S/c1-9(2)16(13,14)12(11-3-4-11)7-10-5-6-15-8-10/h9-11H,3-8H2,1-2H3.
What are the key properties of N-cyclopropyl-N-(oxolan-3-ylmethyl)propane-2-sulfonamide?
N-cyclopropyl-N-(oxolan-3-ylmethyl)propane-2-sulfonamide has a molecular weight of 247.36 g/mol, XLogP of 1.23, 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)propane-2-sulfonamide is sourced from PubChem (CID 61356525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).