N-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride

C10H21ClN2O3S — CID 166150808

IUPACN-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride
SMILESCCS(=O)(=O)NC1COC2(CCNCC2)C1.Cl
InChIInChI=1S/C10H20N2O3S.ClH/c1-2-16(13,14)12-9-7-10(15-8-9)3-5-11-6-4-10;/h9,11-12H,2-8H2,1H3;1H
InChIKeyFZWTUWVWPXMWPU-UHFFFAOYSA-N
MW284.81 g/mol
LogP0.26
Rot. Bonds3

About N-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride

N-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride (PubChem CID 166150808) has the molecular formula C10H21ClN2O3S and a molecular weight of 284.81 g/mol. Its IUPAC name is N-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride.

Molecular Properties

Compound NameN-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride
PubChem CID166150808
Molecular FormulaC10H21ClN2O3S
Molecular Weight284.81 g/mol
Exact Mass284.10
IUPAC NameN-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride
SMILESCCS(=O)(=O)NC1COC2(CCNCC2)C1.Cl
InChIInChI=1S/C10H20N2O3S.ClH/c1-2-16(13,14)12-9-7-10(15-8-9)3-5-11-6-4-10;/h9,11-12H,2-8H2,1H3;1H
InChIKeyFZWTUWVWPXMWPU-UHFFFAOYSA-N
XLogP0.26
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.81
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5R,9S)-2-methyl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide
CID 97476102
N-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide
CID 97477925
N-[(5R,9S)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide
CID 97485996
8-cyclopropylsulfonyl-N,N-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-amine
CID 131661979
N-methyl-N-[(3S)-1-oxa-8-azaspiro[4.5]decan-3-yl]cyclopropanesulfonamide
CID 126506394
N-methyl-N-[(3R)-1-oxa-8-azaspiro[4.5]decan-3-yl]cyclopropanesulfonamide
CID 126506465
N-methyl-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)cyclobutanesulfonamide
CID 126506529
N-methyl-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)cyclopentanesulfonamide
CID 126506909
N,2-dimethyl-N-[(3R)-1-oxa-8-azaspiro[4.5]decan-3-yl]propane-2-sulfonamide
CID 135237429
1-cyclopropyl-N-methyl-N-[(3R)-1-oxa-8-azaspiro[4.5]decan-3-yl]methanesulfonamide
CID 135238150
(R)-N-[(4S)-3,3-dimethyl-1-oxa-8-azaspiro[4.5]decan-4-yl]-2-methylpropane-2-sulfinamide
CID 139427230
N-[(4R)-3,3-dimethyl-1-oxa-8-azaspiro[4.5]decan-4-yl]-2-methylpropane-2-sulfinamide
CID 139427235

Frequently Asked Questions

What is the IUPAC name of N-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride?
The IUPAC name of N-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride (CID 166150808) is N-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride.
What is the SMILES notation for N-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride?
The canonical SMILES for N-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride is CCS(=O)(=O)NC1COC2(CCNCC2)C1.Cl.
What is the InChIKey of N-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride?
The InChIKey is FZWTUWVWPXMWPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3S.ClH/c1-2-16(13,14)12-9-7-10(15-8-9)3-5-11-6-4-10;/h9,11-12H,2-8H2,1H3;1H.
What are the key properties of N-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride?
N-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride has a molecular weight of 284.81 g/mol, XLogP of 0.26, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide;hydrochloride is sourced from PubChem (CID 166150808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).