2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane

C14H20N2O2S — CID 71871364

IUPAC2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane
SMILESO=S(=O)(c1cccnc1)N1CCC2(CCCCC2)C1
InChIInChI=1S/C14H20N2O2S/c17-19(18,13-5-4-9-15-11-13)16-10-8-14(12-16)6-2-1-3-7-14/h4-5,9,11H,1-3,6-8,10,12H2
InChIKeyCYFIPBSCRAFJBO-UHFFFAOYSA-N
MW280.39 g/mol
LogP2.43
Rot. Bonds2

About 2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane

2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane (PubChem CID 71871364) has the molecular formula C14H20N2O2S and a molecular weight of 280.39 g/mol. Its IUPAC name is 2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane.

Molecular Properties

Compound Name2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane
PubChem CID71871364
Molecular FormulaC14H20N2O2S
Molecular Weight280.39 g/mol
Exact Mass280.12
IUPAC Name2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane
SMILESO=S(=O)(c1cccnc1)N1CCC2(CCCCC2)C1
InChIInChI=1S/C14H20N2O2S/c17-19(18,13-5-4-9-15-11-13)16-10-8-14(12-16)6-2-1-3-7-14/h4-5,9,11H,1-3,6-8,10,12H2
InChIKeyCYFIPBSCRAFJBO-UHFFFAOYSA-N
XLogP2.43
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-pyridin-3-ylsulfonyl-2,8-diazaspiro[4.5]decane;hydrochloride
CID 120718656
7-cyclohexyl-2-pyridin-3-ylsulfonyl-2,7-diazaspiro[4.5]decan-6-one
CID 72939411
N-(6-methylpyrimidin-4-yl)-6-pyridin-3-ylsulfonyl-6-azaspiro[3.4]octan-2-amine
CID 155901000
3-(methoxymethyl)-2-methyl-8-pyridin-3-ylsulfonyl-2,8-diazaspiro[4.5]decane
CID 131648490
(5R)-7-propan-2-yl-2-pyridin-3-ylsulfonyl-2,7-diazaspiro[4.5]decan-6-one
CID 97138313
(5S,6S)-8-pyridin-3-ylsulfonyl-1-oxa-8-azaspiro[4.5]decan-6-ol
CID 110159618
[(3S)-3-(cyclopropylmethyl)-1-pyridin-3-ylsulfonylpiperidin-3-yl]methanol
CID 97130526
[4-(2-azaspiro[4.4]nonan-2-ylsulfonyl)phenyl]hydrazine
CID 114279373
4-ethyl-1-pyridin-3-ylsulfonylpiperidine-4-carboxylic acid
CID 63125638
(2S)-1'-pyridin-3-ylsulfonylspiro[3H-chromene-2,3'-pyrrolidine]-4-one
CID 97355023
1-(4-chlorophenyl)sulfonyl-4-pyridin-3-ylsulfonylpiperazine
CID 154834810
3-(4-bromopiperidin-1-yl)sulfonylpyridine
CID 80672721

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane?
The IUPAC name of 2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane (CID 71871364) is 2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane.
What is the SMILES notation for 2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane?
The canonical SMILES for 2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane is O=S(=O)(c1cccnc1)N1CCC2(CCCCC2)C1.
What is the InChIKey of 2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane?
The InChIKey is CYFIPBSCRAFJBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2S/c17-19(18,13-5-4-9-15-11-13)16-10-8-14(12-16)6-2-1-3-7-14/h4-5,9,11H,1-3,6-8,10,12H2.
What are the key properties of 2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane?
2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane has a molecular weight of 280.39 g/mol, XLogP of 2.43, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-3-ylsulfonyl-2-azaspiro[4.5]decane is sourced from PubChem (CID 71871364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).