N-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide

C9H18N2O3S — CID 97420107

IUPACN-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide
SMILESCS(=O)(=O)N[C@H]1CCO[C@]2(CCNC2)C1
InChIInChI=1S/C9H18N2O3S/c1-15(12,13)11-8-2-5-14-9(6-8)3-4-10-7-9/h8,10-11H,2-7H2,1H3/t8-,9+/m0/s1
InChIKeyQWYTVWYPWLIEPA-DTWKUNHWSA-N
MW234.32 g/mol
LogP-0.55
Rot. Bonds2

About N-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide

N-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide (PubChem CID 97420107) has the molecular formula C9H18N2O3S and a molecular weight of 234.32 g/mol. Its IUPAC name is N-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide
PubChem CID97420107
Molecular FormulaC9H18N2O3S
Molecular Weight234.32 g/mol
Exact Mass234.10
IUPAC NameN-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide
SMILESCS(=O)(=O)N[C@H]1CCO[C@]2(CCNC2)C1
InChIInChI=1S/C9H18N2O3S/c1-15(12,13)11-8-2-5-14-9(6-8)3-4-10-7-9/h8,10-11H,2-7H2,1H3/t8-,9+/m0/s1
InChIKeyQWYTVWYPWLIEPA-DTWKUNHWSA-N
XLogP-0.55
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 5-0.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide?
The IUPAC name of N-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide (CID 97420107) is N-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide.
What is the SMILES notation for N-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide?
The canonical SMILES for N-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide is CS(=O)(=O)N[C@H]1CCO[C@]2(CCNC2)C1.
What is the InChIKey of N-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide?
The InChIKey is QWYTVWYPWLIEPA-DTWKUNHWSA-N. The full InChI is InChI=1S/C9H18N2O3S/c1-15(12,13)11-8-2-5-14-9(6-8)3-4-10-7-9/h8,10-11H,2-7H2,1H3/t8-,9+/m0/s1.
What are the key properties of N-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide?
N-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide has a molecular weight of 234.32 g/mol, XLogP of -0.55, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide is sourced from PubChem (CID 97420107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).