2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol

C20H36O5 — CID 44303261

About 2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol

2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol (PubChem CID 44303261) has the molecular formula C20H36O5 and a molecular weight of 356.50 g/mol. Its IUPAC name is 2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol.

Molecular Properties

• Compound Name: 2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol
• PubChem CID: 44303261
• Molecular Formula: C20H36O5
• Molecular Weight: 356.50 g/mol
• Exact Mass: 356.26
• IUPAC Name: 2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol
• SMILES: C[C@]1(CC[C@@H](O1)C(C)(C)O)[C@H]2CC[C@H](O2)[C@]3(CC[C@H](O3)C(C)(C)O)C
• InChI: InChI=1S/C20H36O5/c1-17(2,21)13-9-11-19(5,24-13)15-7-8-16(23-15)20(6)12-10-14(25-20)18(3,4)22/h13-16,21-22H,7-12H2,1-6H3/t13-,14+,15-,16+,19+,20-
• InChIKey: RWTJAWXRNLZFQP-AQMNOWNJSA-N
• XLogP: 1.90
• TPSA: 68.20 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 25
• Complexity: 460

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	356.50
LogP ≤ 5	1.90
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol?

The IUPAC name of 2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol (CID 44303261) is 2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol.

What is the SMILES notation for 2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol?

The canonical SMILES for 2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol is C[C@]1(CC[C@@H](O1)C(C)(C)O)[C@H]2CC[C@H](O2)[C@]3(CC[C@H](O3)C(C)(C)O)C.

What is the InChIKey of 2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol?

The InChIKey is RWTJAWXRNLZFQP-AQMNOWNJSA-N. The full InChI is InChI=1S/C20H36O5/c1-17(2,21)13-9-11-19(5,24-13)15-7-8-16(23-15)20(6)12-10-14(25-20)18(3,4)22/h13-16,21-22H,7-12H2,1-6H3/t13-,14+,15-,16+,19+,20-.

What are the key properties of 2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol?

2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol has a molecular weight of 356.50 g/mol, XLogP of 1.90, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol is sourced from PubChem (CID 44303261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).