N,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide

C9H17N3O4S — CID 3057778

IUPACN,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC2(CC1)CNC(=O)O2
InChIInChI=1S/C9H17N3O4S/c1-11(2)17(14,15)12-5-3-9(4-6-12)7-10-8(13)16-9/h3-7H2,1-2H3,(H,10,13)
InChIKeyXWNZRJCSUSVOTC-UHFFFAOYSA-N
MW263.32 g/mol
LogP-0.63
Rot. Bonds2

About N,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide

N,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide (PubChem CID 3057778) has the molecular formula C9H17N3O4S and a molecular weight of 263.32 g/mol. Its IUPAC name is N,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide
PubChem CID3057778
Molecular FormulaC9H17N3O4S
Molecular Weight263.32 g/mol
Exact Mass263.09
IUPAC NameN,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC2(CC1)CNC(=O)O2
InChIInChI=1S/C9H17N3O4S/c1-11(2)17(14,15)12-5-3-9(4-6-12)7-10-8(13)16-9/h3-7H2,1-2H3,(H,10,13)
InChIKeyXWNZRJCSUSVOTC-UHFFFAOYSA-N
XLogP-0.63
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 5-0.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-Oxa-3,8-diazaspiro(4.5)decan-2-one, 8-dimethylsulfamoyl-, hydrochloride
CID 3057777
1-Oxa-3,8-diazaspiro(4.5)decan 2-one
CID 12954114
3-Ethyl-1-oxa-3,8-diazaspiro(4.5)decan-2-one hydrochloride
CID 117272867
3-Methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 10329737
3-Ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 20286526
Tert-butyl 2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxylate
CID 10015278
4-Methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 15671039
3-Propyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 20286470
3-Butyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 20286551
8-Ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 20622668
1-Oxa-3,8-diazaspiro[4.5]decan-2-one, acetate salt
CID 21268372
8,8-Dimethyl-2-oxo-1-oxa-3-aza-8-azoniaspiro[4.5]decane chloride
CID 46202673

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide?
The IUPAC name of N,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide (CID 3057778) is N,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide.
What is the SMILES notation for N,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide?
The canonical SMILES for N,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide is CN(C)S(=O)(=O)N1CCC2(CC1)CNC(=O)O2.
What is the InChIKey of N,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide?
The InChIKey is XWNZRJCSUSVOTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O4S/c1-11(2)17(14,15)12-5-3-9(4-6-12)7-10-8(13)16-9/h3-7H2,1-2H3,(H,10,13).
What are the key properties of N,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide?
N,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide has a molecular weight of 263.32 g/mol, XLogP of -0.63, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-sulfonamide is sourced from PubChem (CID 3057778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).