(1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol

C21H24O3 — CID 125036537

IUPAC(1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol
SMILESO[C@@H]1CCC=C1c1cc(C2=CCC[C@H]2O)cc(C2=CCC[C@H]2O)c1
InChIInChI=1S/C21H24O3/c22-19-7-1-4-16(19)13-10-14(17-5-2-8-20(17)23)12-15(11-13)18-6-3-9-21(18)24/h4-6,10-12,19-24H,1-3,7-9H2/t19-,20-,21-/m1/s1
InChIKeyWXSBWHZSNSZWLJ-NJDAHSKKSA-N
MW324.42 g/mol
LogP3.30
Rot. Bonds3

About (1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol

(1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol (PubChem CID 125036537) has the molecular formula C21H24O3 and a molecular weight of 324.42 g/mol. Its IUPAC name is (1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol.

Molecular Properties

Compound Name(1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol
PubChem CID125036537
Molecular FormulaC21H24O3
Molecular Weight324.42 g/mol
Exact Mass324.17
IUPAC Name(1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol
SMILESO[C@@H]1CCC=C1c1cc(C2=CCC[C@H]2O)cc(C2=CCC[C@H]2O)c1
InChIInChI=1S/C21H24O3/c22-19-7-1-4-16(19)13-10-14(17-5-2-8-20(17)23)12-15(11-13)18-6-3-9-21(18)24/h4-6,10-12,19-24H,1-3,7-9H2/t19-,20-,21-/m1/s1
InChIKeyWXSBWHZSNSZWLJ-NJDAHSKKSA-N
XLogP3.30
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol?
The IUPAC name of (1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol (CID 125036537) is (1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol.
What is the SMILES notation for (1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol?
The canonical SMILES for (1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol is O[C@@H]1CCC=C1c1cc(C2=CCC[C@H]2O)cc(C2=CCC[C@H]2O)c1.
What is the InChIKey of (1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol?
The InChIKey is WXSBWHZSNSZWLJ-NJDAHSKKSA-N. The full InChI is InChI=1S/C21H24O3/c22-19-7-1-4-16(19)13-10-14(17-5-2-8-20(17)23)12-15(11-13)18-6-3-9-21(18)24/h4-6,10-12,19-24H,1-3,7-9H2/t19-,20-,21-/m1/s1.
What are the key properties of (1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol?
(1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol has a molecular weight of 324.42 g/mol, XLogP of 3.30, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-[3,5-bis[(5R)-5-hydroxycyclopenten-1-yl]phenyl]cyclopent-2-en-1-ol is sourced from PubChem (CID 125036537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).