N-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide

C15H22N2O3S — CID 43597956

IUPACN-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide
SMILESCOc1ccccc1S(=O)(=O)NC1CCNC2(CCC2)C1
InChIInChI=1S/C15H22N2O3S/c1-20-13-5-2-3-6-14(13)21(18,19)17-12-7-10-16-15(11-12)8-4-9-15/h2-3,5-6,12,16-17H,4,7-11H2,1H3
InChIKeyPKMDBKCLQTXSDJ-UHFFFAOYSA-N
MW310.42 g/mol
LogP1.65
Rot. Bonds4

About N-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide

N-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide (PubChem CID 43597956) has the molecular formula C15H22N2O3S and a molecular weight of 310.42 g/mol. Its IUPAC name is N-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide.

Molecular Properties

Compound NameN-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide
PubChem CID43597956
Molecular FormulaC15H22N2O3S
Molecular Weight310.42 g/mol
Exact Mass310.14
IUPAC NameN-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide
SMILESCOc1ccccc1S(=O)(=O)NC1CCNC2(CCC2)C1
InChIInChI=1S/C15H22N2O3S/c1-20-13-5-2-3-6-14(13)21(18,19)17-12-7-10-16-15(11-12)8-4-9-15/h2-3,5-6,12,16-17H,4,7-11H2,1H3
InChIKeyPKMDBKCLQTXSDJ-UHFFFAOYSA-N
XLogP1.65
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-azaspiro[3.5]nonan-8-yl)-2-fluorobenzenesulfonamide
CID 43597983
2-methoxy-N-piperidin-4-ylbenzenesulfonamide
CID 43603348
N-(5-azaspiro[3.5]nonan-8-yl)-5-chloro-2-methylbenzenesulfonamide
CID 43597921
N-(5-azaspiro[3.5]nonan-8-yl)-2-(2-methoxyphenyl)acetamide
CID 43595335
N-(5-azaspiro[3.5]nonan-8-yl)-2-bromo-4-methylbenzenesulfonamide
CID 43597913
N-(5-azaspiro[3.5]nonan-8-yl)-2-cyanopyridine-3-sulfonamide
CID 106598352
N-(4-azaspiro[2.5]octan-7-yl)-4-phenoxybenzenesulfonamide
CID 166269430
N-(5-azaspiro[3.5]nonan-8-yl)-5-ethylthiophene-2-sulfonamide
CID 61454324
N-(5-azaspiro[3.5]nonan-8-yl)-3-bromo-4-chlorobenzenesulfonamide
CID 106606485
N-(1-azaspiro[5.5]undecan-4-yl)-2-methylpropane-2-sulfonamide
CID 63688997
N-(propylsulfamoyl)-5-azaspiro[3.5]nonan-8-amine
CID 114810353
N-(5-azaspiro[3.5]nonan-8-yl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
CID 43597909

Frequently Asked Questions

What is the IUPAC name of N-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide?
The IUPAC name of N-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide (CID 43597956) is N-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide.
What is the SMILES notation for N-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide?
The canonical SMILES for N-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide is COc1ccccc1S(=O)(=O)NC1CCNC2(CCC2)C1.
What is the InChIKey of N-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide?
The InChIKey is PKMDBKCLQTXSDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3S/c1-20-13-5-2-3-6-14(13)21(18,19)17-12-7-10-16-15(11-12)8-4-9-15/h2-3,5-6,12,16-17H,4,7-11H2,1H3.
What are the key properties of N-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide?
N-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide has a molecular weight of 310.42 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide is sourced from PubChem (CID 43597956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).