(8R)-8-[(5-methyl-3-pyridinyl)methoxy]-2-(thiophen-3-ylmethyl)-5-oxa-2-azaspiro[3.5]nonane

C19H24N2O2S — CID 124913867

About (8R)-8-[(5-methyl-3-pyridinyl)methoxy]-2-(thiophen-3-ylmethyl)-5-oxa-2-azaspiro[3.5]nonane

(8R)-8-[(5-methyl-3-pyridinyl)methoxy]-2-(thiophen-3-ylmethyl)-5-oxa-2-azaspiro[3.5]nonane (PubChem CID 124913867) has the molecular formula C19H24N2O2S and a molecular weight of 344.48 g/mol. Its IUPAC name is (8R)-8-[(5-methyl-3-pyridinyl)methoxy]-2-(thiophen-3-ylmethyl)-5-oxa-2-azaspiro[3.5]nonane.

Molecular Properties

• Compound Name: (8R)-8-[(5-methyl-3-pyridinyl)methoxy]-2-(thiophen-3-ylmethyl)-5-oxa-2-azaspiro[3.5]nonane
• PubChem CID: 124913867
• Molecular Formula: C19H24N2O2S
• Molecular Weight: 344.48 g/mol
• Exact Mass: 344.16
• IUPAC Name: (8R)-8-[(5-methyl-3-pyridinyl)methoxy]-2-(thiophen-3-ylmethyl)-5-oxa-2-azaspiro[3.5]nonane
• SMILES: Cc1cncc(CO[C@@H]2CCOC3(C2)CN(Cc2ccsc2)C3)c1
• InChI: InChI=1S/C19H24N2O2S/c1-15-6-17(9-20-8-15)11-22-18-2-4-23-19(7-18)13-21(14-19)10-16-3-5-24-12-16/h3,5-6,8-9,12,18H,2,4,7,10-11,13-14H2,1H3/t18-/m1/s1
• InChIKey: YBMWENRJYCIJPP-GOSISDBHSA-N
• XLogP: 3.40
• TPSA: 34.59 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	344.48
LogP ≤ 5	3.40
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of (8R)-8-[(5-methyl-3-pyridinyl)methoxy]-2-(thiophen-3-ylmethyl)-5-oxa-2-azaspiro[3.5]nonane?

The IUPAC name of (8R)-8-[(5-methyl-3-pyridinyl)methoxy]-2-(thiophen-3-ylmethyl)-5-oxa-2-azaspiro[3.5]nonane (CID 124913867) is (8R)-8-[(5-methyl-3-pyridinyl)methoxy]-2-(thiophen-3-ylmethyl)-5-oxa-2-azaspiro[3.5]nonane.

What is the SMILES notation for (8R)-8-[(5-methyl-3-pyridinyl)methoxy]-2-(thiophen-3-ylmethyl)-5-oxa-2-azaspiro[3.5]nonane?

The canonical SMILES for (8R)-8-[(5-methyl-3-pyridinyl)methoxy]-2-(thiophen-3-ylmethyl)-5-oxa-2-azaspiro[3.5]nonane is Cc1cncc(CO[C@@H]2CCOC3(C2)CN(Cc2ccsc2)C3)c1.

What is the InChIKey of (8R)-8-[(5-methyl-3-pyridinyl)methoxy]-2-(thiophen-3-ylmethyl)-5-oxa-2-azaspiro[3.5]nonane?

The InChIKey is YBMWENRJYCIJPP-GOSISDBHSA-N. The full InChI is InChI=1S/C19H24N2O2S/c1-15-6-17(9-20-8-15)11-22-18-2-4-23-19(7-18)13-21(14-19)10-16-3-5-24-12-16/h3,5-6,8-9,12,18H,2,4,7,10-11,13-14H2,1H3/t18-/m1/s1.

What are the key properties of (8R)-8-[(5-methyl-3-pyridinyl)methoxy]-2-(thiophen-3-ylmethyl)-5-oxa-2-azaspiro[3.5]nonane?

(8R)-8-[(5-methyl-3-pyridinyl)methoxy]-2-(thiophen-3-ylmethyl)-5-oxa-2-azaspiro[3.5]nonane has a molecular weight of 344.48 g/mol, XLogP of 3.40, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for (8R)-8-[(5-methyl-3-pyridinyl)methoxy]-2-(thiophen-3-ylmethyl)-5-oxa-2-azaspiro[3.5]nonane is sourced from PubChem (CID 124913867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).