1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide

C11H22N2O2S — CID 156624842

IUPAC1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide
SMILESCC(C[C@@H]1COCC12CCNCC2)S(N)=O
InChIInChI=1S/C11H22N2O2S/c1-9(16(12)14)6-10-7-15-8-11(10)2-4-13-5-3-11/h9-10,13H,2-8,12H2,1H3/t9?,10-,16?/m1/s1
InChIKeyKVFVCHILCHFBIQ-IAZHFHGHSA-N
MW246.38 g/mol
LogP0.40
Rot. Bonds3

About 1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide

1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide (PubChem CID 156624842) has the molecular formula C11H22N2O2S and a molecular weight of 246.38 g/mol. Its IUPAC name is 1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide.

Molecular Properties

Compound Name1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide
PubChem CID156624842
Molecular FormulaC11H22N2O2S
Molecular Weight246.38 g/mol
Exact Mass246.14
IUPAC Name1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide
SMILESCC(C[C@@H]1COCC12CCNCC2)S(N)=O
InChIInChI=1S/C11H22N2O2S/c1-9(16(12)14)6-10-7-15-8-11(10)2-4-13-5-3-11/h9-10,13H,2-8,12H2,1H3/t9?,10-,16?/m1/s1
InChIKeyKVFVCHILCHFBIQ-IAZHFHGHSA-N
XLogP0.40
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide 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 1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide?
The IUPAC name of 1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide (CID 156624842) is 1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide.
What is the SMILES notation for 1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide?
The canonical SMILES for 1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide is CC(C[C@@H]1COCC12CCNCC2)S(N)=O.
What is the InChIKey of 1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide?
The InChIKey is KVFVCHILCHFBIQ-IAZHFHGHSA-N. The full InChI is InChI=1S/C11H22N2O2S/c1-9(16(12)14)6-10-7-15-8-11(10)2-4-13-5-3-11/h9-10,13H,2-8,12H2,1H3/t9?,10-,16?/m1/s1.
What are the key properties of 1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide?
1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide has a molecular weight of 246.38 g/mol, XLogP of 0.40, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4S)-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide is sourced from PubChem (CID 156624842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).