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

C14H22N2O2S2 — CID 61454324

IUPACN-(5-azaspiro[3.5]nonan-8-yl)-5-ethylthiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NC2CCNC3(CCC3)C2)s1
InChIInChI=1S/C14H22N2O2S2/c1-2-12-4-5-13(19-12)20(17,18)16-11-6-9-15-14(10-11)7-3-8-14/h4-5,11,15-16H,2-3,6-10H2,1H3
InChIKeyTVLSKHHCNDWXRR-UHFFFAOYSA-N
MW314.48 g/mol
LogP2.26
Rot. Bonds4

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

N-(5-azaspiro[3.5]nonan-8-yl)-5-ethylthiophene-2-sulfonamide (PubChem CID 61454324) has the molecular formula C14H22N2O2S2 and a molecular weight of 314.48 g/mol. Its IUPAC name is N-(5-azaspiro[3.5]nonan-8-yl)-5-ethylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(5-azaspiro[3.5]nonan-8-yl)-5-ethylthiophene-2-sulfonamide
PubChem CID61454324
Molecular FormulaC14H22N2O2S2
Molecular Weight314.48 g/mol
Exact Mass314.11
IUPAC NameN-(5-azaspiro[3.5]nonan-8-yl)-5-ethylthiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NC2CCNC3(CCC3)C2)s1
InChIInChI=1S/C14H22N2O2S2/c1-2-12-4-5-13(19-12)20(17,18)16-11-6-9-15-14(10-11)7-3-8-14/h4-5,11,15-16H,2-3,6-10H2,1H3
InChIKeyTVLSKHHCNDWXRR-UHFFFAOYSA-N
XLogP2.26
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.48
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-5-ethylthiophene-2-sulfonamide
CID 61061009
N-(5-azaspiro[3.5]nonan-8-yl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
CID 43597909
N-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide
CID 43597956
4-[(5-ethylthiophen-2-yl)sulfonylamino]cyclohexane-1-carboxylic acid
CID 61454626
N-(5-azaspiro[3.5]nonan-8-yl)-5-chloro-2-methylbenzenesulfonamide
CID 43597921
N-(propylsulfamoyl)-5-azaspiro[3.5]nonan-8-amine
CID 114810353
methyl 4-[(5-ethylthiophen-2-yl)sulfonylamino]piperidine-1-carboxylate
CID 86841914
N-[2-(bromomethyl)cyclopentyl]-5-ethylthiophene-2-sulfonamide
CID 106367504
5-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)thiophene-2-sulfonamide
CID 110736772
N-[1-(chloromethyl)cyclopentyl]-5-ethylthiophene-2-sulfonamide
CID 65031136
N-(5-azaspiro[3.5]nonan-8-yl)-2-cyanopyridine-3-sulfonamide
CID 106598352
N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-5-ethylthiophene-2-sulfonamide
CID 127470974

Frequently Asked Questions

What is the IUPAC name of N-(5-azaspiro[3.5]nonan-8-yl)-5-ethylthiophene-2-sulfonamide?
The IUPAC name of N-(5-azaspiro[3.5]nonan-8-yl)-5-ethylthiophene-2-sulfonamide (CID 61454324) is N-(5-azaspiro[3.5]nonan-8-yl)-5-ethylthiophene-2-sulfonamide.
What is the SMILES notation for N-(5-azaspiro[3.5]nonan-8-yl)-5-ethylthiophene-2-sulfonamide?
The canonical SMILES for N-(5-azaspiro[3.5]nonan-8-yl)-5-ethylthiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)NC2CCNC3(CCC3)C2)s1.
What is the InChIKey of N-(5-azaspiro[3.5]nonan-8-yl)-5-ethylthiophene-2-sulfonamide?
The InChIKey is TVLSKHHCNDWXRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2S2/c1-2-12-4-5-13(19-12)20(17,18)16-11-6-9-15-14(10-11)7-3-8-14/h4-5,11,15-16H,2-3,6-10H2,1H3.
What are the key properties of N-(5-azaspiro[3.5]nonan-8-yl)-5-ethylthiophene-2-sulfonamide?
N-(5-azaspiro[3.5]nonan-8-yl)-5-ethylthiophene-2-sulfonamide has a molecular weight of 314.48 g/mol, XLogP of 2.26, 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)-5-ethylthiophene-2-sulfonamide is sourced from PubChem (CID 61454324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).