N-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide

C11H19NO3S — CID 122276541

IUPACN-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide
SMILESO=S(=O)(NC1CCC12CCOCC2)C1CC1
InChIInChI=1S/C11H19NO3S/c13-16(14,9-1-2-9)12-10-3-4-11(10)5-7-15-8-6-11/h9-10,12H,1-8H2
InChIKeyALXBBCHDJMPRRM-UHFFFAOYSA-N
MW245.34 g/mol
LogP1.03
Rot. Bonds3

About N-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide

N-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide (PubChem CID 122276541) has the molecular formula C11H19NO3S and a molecular weight of 245.34 g/mol. Its IUPAC name is N-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide
PubChem CID122276541
Molecular FormulaC11H19NO3S
Molecular Weight245.34 g/mol
Exact Mass245.11
IUPAC NameN-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide
SMILESO=S(=O)(NC1CCC12CCOCC2)C1CC1
InChIInChI=1S/C11H19NO3S/c13-16(14,9-1-2-9)12-10-3-4-11(10)5-7-15-8-6-11/h9-10,12H,1-8H2
InChIKeyALXBBCHDJMPRRM-UHFFFAOYSA-N
XLogP1.03
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.34
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide?
The IUPAC name of N-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide (CID 122276541) is N-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide.
What is the SMILES notation for N-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide?
The canonical SMILES for N-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide is O=S(=O)(NC1CCC12CCOCC2)C1CC1.
What is the InChIKey of N-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide?
The InChIKey is ALXBBCHDJMPRRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3S/c13-16(14,9-1-2-9)12-10-3-4-11(10)5-7-15-8-6-11/h9-10,12H,1-8H2.
What are the key properties of N-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide?
N-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide has a molecular weight of 245.34 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-oxaspiro[3.5]nonan-3-yl)cyclopropanesulfonamide is sourced from PubChem (CID 122276541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).