(1R,4S)-3,4-diphenylcyclopent-2-en-1-ol

C17H16O — CID 92533373

IUPAC(1R,4S)-3,4-diphenylcyclopent-2-en-1-ol
SMILESO[C@H]1C=C(c2ccccc2)[C@H](c2ccccc2)C1
InChIInChI=1S/C17H16O/c18-15-11-16(13-7-3-1-4-8-13)17(12-15)14-9-5-2-6-10-14/h1-11,15,17-18H,12H2/t15-,17-/m0/s1
InChIKeyPPTPDVUKNXBQME-RDJZCZTQSA-N
MW236.31 g/mol
LogP3.62
Rot. Bonds2

About (1R,4S)-3,4-diphenylcyclopent-2-en-1-ol

(1R,4S)-3,4-diphenylcyclopent-2-en-1-ol (PubChem CID 92533373) has the molecular formula C17H16O and a molecular weight of 236.31 g/mol. Its IUPAC name is (1R,4S)-3,4-diphenylcyclopent-2-en-1-ol.

Molecular Properties

Compound Name(1R,4S)-3,4-diphenylcyclopent-2-en-1-ol
PubChem CID92533373
Molecular FormulaC17H16O
Molecular Weight236.31 g/mol
Exact Mass236.12
IUPAC Name(1R,4S)-3,4-diphenylcyclopent-2-en-1-ol
SMILESO[C@H]1C=C(c2ccccc2)[C@H](c2ccccc2)C1
InChIInChI=1S/C17H16O/c18-15-11-16(13-7-3-1-4-8-13)17(12-15)14-9-5-2-6-10-14/h1-11,15,17-18H,12H2/t15-,17-/m0/s1
InChIKeyPPTPDVUKNXBQME-RDJZCZTQSA-N
XLogP3.62
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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(2-phenylcycloprop-2-en-1-yl)benzene
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CID 98512869
2,4-diphenylbicyclo[3.2.1]oct-2-ene
CID 71394656
4-methyl-3-phenylcyclobut-2-en-1-ol
CID 123879826
(6R)-2,5-diphenylbicyclo[4.1.0]hepta-2,4-diene
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CID 68719725

Frequently Asked Questions

What is the IUPAC name of (1R,4S)-3,4-diphenylcyclopent-2-en-1-ol?
The IUPAC name of (1R,4S)-3,4-diphenylcyclopent-2-en-1-ol (CID 92533373) is (1R,4S)-3,4-diphenylcyclopent-2-en-1-ol.
What is the SMILES notation for (1R,4S)-3,4-diphenylcyclopent-2-en-1-ol?
The canonical SMILES for (1R,4S)-3,4-diphenylcyclopent-2-en-1-ol is O[C@H]1C=C(c2ccccc2)[C@H](c2ccccc2)C1.
What is the InChIKey of (1R,4S)-3,4-diphenylcyclopent-2-en-1-ol?
The InChIKey is PPTPDVUKNXBQME-RDJZCZTQSA-N. The full InChI is InChI=1S/C17H16O/c18-15-11-16(13-7-3-1-4-8-13)17(12-15)14-9-5-2-6-10-14/h1-11,15,17-18H,12H2/t15-,17-/m0/s1.
What are the key properties of (1R,4S)-3,4-diphenylcyclopent-2-en-1-ol?
(1R,4S)-3,4-diphenylcyclopent-2-en-1-ol has a molecular weight of 236.31 g/mol, XLogP of 3.62, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,4S)-3,4-diphenylcyclopent-2-en-1-ol is sourced from PubChem (CID 92533373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).