(3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane

C10H19NO4S — CID 97371516

IUPAC(3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane
SMILESCO[C@H]1COC2(CCN(S(C)(=O)=O)CC2)C1
InChIInChI=1S/C10H19NO4S/c1-14-9-7-10(15-8-9)3-5-11(6-4-10)16(2,12)13/h9H,3-8H2,1-2H3/t9-/m1/s1
InChIKeyRBKPOFDMMXWARQ-SECBINFHSA-N
MW249.33 g/mol
LogP0.22
Rot. Bonds2

About (3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane

(3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane (PubChem CID 97371516) has the molecular formula C10H19NO4S and a molecular weight of 249.33 g/mol. Its IUPAC name is (3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name(3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane
PubChem CID97371516
Molecular FormulaC10H19NO4S
Molecular Weight249.33 g/mol
Exact Mass249.10
IUPAC Name(3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane
SMILESCO[C@H]1COC2(CCN(S(C)(=O)=O)CC2)C1
InChIInChI=1S/C10H19NO4S/c1-14-9-7-10(15-8-9)3-5-11(6-4-10)16(2,12)13/h9H,3-8H2,1-2H3/t9-/m1/s1
InChIKeyRBKPOFDMMXWARQ-SECBINFHSA-N
XLogP0.22
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 50.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane 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 (3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane?
The IUPAC name of (3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane (CID 97371516) is (3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for (3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for (3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane is CO[C@H]1COC2(CCN(S(C)(=O)=O)CC2)C1.
What is the InChIKey of (3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane?
The InChIKey is RBKPOFDMMXWARQ-SECBINFHSA-N. The full InChI is InChI=1S/C10H19NO4S/c1-14-9-7-10(15-8-9)3-5-11(6-4-10)16(2,12)13/h9H,3-8H2,1-2H3/t9-/m1/s1.
What are the key properties of (3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane?
(3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane has a molecular weight of 249.33 g/mol, XLogP of 0.22, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-methoxy-8-methylsulfonyl-1-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 97371516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).