(2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol

C21H44O8 — CID 11963525

IUPAC(2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol
SMILESC[C@H](O)CO[C@H](C)CO[C@H](C)CO[C@@H](C)CO[C@@H](C)CO[C@@H](C)COC[C@@H](C)O
InChIInChI=1S/C21H44O8/c1-15(22)8-24-10-17(3)26-12-19(5)28-14-21(7)29-13-20(6)27-11-18(4)25-9-16(2)23/h15-23H,8-14H2,1-7H3/t15-,16+,17+,18-,19+,20-,21+/m1/s1
InChIKeyXGDXHSHOQKNIEW-YSPFXGIPSA-N
MW424.58 g/mol
LogP1.79
Rot. Bonds19

About (2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol

(2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol (PubChem CID 11963525) has the molecular formula C21H44O8 and a molecular weight of 424.58 g/mol. Its IUPAC name is (2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol
PubChem CID11963525
Molecular FormulaC21H44O8
Molecular Weight424.58 g/mol
Exact Mass424.30
IUPAC Name(2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol
SMILESC[C@H](O)CO[C@H](C)CO[C@H](C)CO[C@@H](C)CO[C@@H](C)CO[C@@H](C)COC[C@@H](C)O
InChIInChI=1S/C21H44O8/c1-15(22)8-24-10-17(3)26-12-19(5)28-14-21(7)29-13-20(6)27-11-18(4)25-9-16(2)23/h15-23H,8-14H2,1-7H3/t15-,16+,17+,18-,19+,20-,21+/m1/s1
InChIKeyXGDXHSHOQKNIEW-YSPFXGIPSA-N
XLogP1.79
TPSA95.84 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds19
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.58
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze (2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol?
The IUPAC name of (2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol (CID 11963525) is (2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol.
What is the SMILES notation for (2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol?
The canonical SMILES for (2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol is C[C@H](O)CO[C@H](C)CO[C@H](C)CO[C@@H](C)CO[C@@H](C)CO[C@@H](C)COC[C@@H](C)O.
What is the InChIKey of (2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol?
The InChIKey is XGDXHSHOQKNIEW-YSPFXGIPSA-N. The full InChI is InChI=1S/C21H44O8/c1-15(22)8-24-10-17(3)26-12-19(5)28-14-21(7)29-13-20(6)27-11-18(4)25-9-16(2)23/h15-23H,8-14H2,1-7H3/t15-,16+,17+,18-,19+,20-,21+/m1/s1.
What are the key properties of (2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol?
(2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol has a molecular weight of 424.58 g/mol, XLogP of 1.79, 19 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-2-ol is sourced from PubChem (CID 11963525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).