N-[[(7R)-2-(1,3-thiazol-2-ylmethyl)-5-oxa-2-azaspiro[3.5]nonan-7-yl]methyl]cyclopropanesulfonamide

C15H23N3O3S2 — CID 124779261

About N-[[(7R)-2-(1,3-thiazol-2-ylmethyl)-5-oxa-2-azaspiro[3.5]nonan-7-yl]methyl]cyclopropanesulfonamide

N-[[(7R)-2-(1,3-thiazol-2-ylmethyl)-5-oxa-2-azaspiro[3.5]nonan-7-yl]methyl]cyclopropanesulfonamide (PubChem CID 124779261) has the molecular formula C15H23N3O3S2 and a molecular weight of 357.50 g/mol. Its IUPAC name is N-[[(7R)-2-(1,3-thiazol-2-ylmethyl)-5-oxa-2-azaspiro[3.5]nonan-7-yl]methyl]cyclopropanesulfonamide.

Molecular Properties

• Compound Name: N-[[(7R)-2-(1,3-thiazol-2-ylmethyl)-5-oxa-2-azaspiro[3.5]nonan-7-yl]methyl]cyclopropanesulfonamide
• PubChem CID: 124779261
• Molecular Formula: C15H23N3O3S2
• Molecular Weight: 357.50 g/mol
• Exact Mass: 357.12
• IUPAC Name: N-[[(7R)-2-(1,3-thiazol-2-ylmethyl)-5-oxa-2-azaspiro[3.5]nonan-7-yl]methyl]cyclopropanesulfonamide
• SMILES: O=S(=O)(NC[C@H]1CCC2(CN(Cc3nccs3)C2)OC1)C1CC1
• InChI: InChI=1S/C15H23N3O3S2/c19-23(20,13-1-2-13)17-7-12-3-4-15(21-9-12)10-18(11-15)8-14-16-5-6-22-14/h5-6,12-13,17H,1-4,7-11H2/t12-/m1/s1
• InChIKey: GXAOUUYQPLHADR-GFCCVEGCSA-N
• XLogP: 1.21
• TPSA: 71.53 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	357.50
LogP ≤ 5	1.21
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[[(7R)-2-(1,3-thiazol-2-ylmethyl)-5-oxa-2-azaspiro[3.5]nonan-7-yl]methyl]cyclopropanesulfonamide?

The IUPAC name of N-[[(7R)-2-(1,3-thiazol-2-ylmethyl)-5-oxa-2-azaspiro[3.5]nonan-7-yl]methyl]cyclopropanesulfonamide (CID 124779261) is N-[[(7R)-2-(1,3-thiazol-2-ylmethyl)-5-oxa-2-azaspiro[3.5]nonan-7-yl]methyl]cyclopropanesulfonamide.

What is the SMILES notation for N-[[(7R)-2-(1,3-thiazol-2-ylmethyl)-5-oxa-2-azaspiro[3.5]nonan-7-yl]methyl]cyclopropanesulfonamide?

The canonical SMILES for N-[[(7R)-2-(1,3-thiazol-2-ylmethyl)-5-oxa-2-azaspiro[3.5]nonan-7-yl]methyl]cyclopropanesulfonamide is O=S(=O)(NC[C@H]1CCC2(CN(Cc3nccs3)C2)OC1)C1CC1.

What is the InChIKey of N-[[(7R)-2-(1,3-thiazol-2-ylmethyl)-5-oxa-2-azaspiro[3.5]nonan-7-yl]methyl]cyclopropanesulfonamide?

The InChIKey is GXAOUUYQPLHADR-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H23N3O3S2/c19-23(20,13-1-2-13)17-7-12-3-4-15(21-9-12)10-18(11-15)8-14-16-5-6-22-14/h5-6,12-13,17H,1-4,7-11H2/t12-/m1/s1.

What are the key properties of N-[[(7R)-2-(1,3-thiazol-2-ylmethyl)-5-oxa-2-azaspiro[3.5]nonan-7-yl]methyl]cyclopropanesulfonamide?

N-[[(7R)-2-(1,3-thiazol-2-ylmethyl)-5-oxa-2-azaspiro[3.5]nonan-7-yl]methyl]cyclopropanesulfonamide has a molecular weight of 357.50 g/mol, XLogP of 1.21, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[[(7R)-2-(1,3-thiazol-2-ylmethyl)-5-oxa-2-azaspiro[3.5]nonan-7-yl]methyl]cyclopropanesulfonamide is sourced from PubChem (CID 124779261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).