(2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol

C13H16O2 — CID 141197729

IUPAC(2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol
SMILESOC[C@@H](Cc1ccccc1)[C@@H]1C=CCO1
InChIInChI=1S/C13H16O2/c14-10-12(13-7-4-8-15-13)9-11-5-2-1-3-6-11/h1-7,12-14H,8-10H2/t12-,13+/m1/s1
InChIKeyDVPDIGYKHVXURY-OLZOCXBDSA-N
MW204.27 g/mol
LogP1.79
Rot. Bonds4

About (2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol

(2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol (PubChem CID 141197729) has the molecular formula C13H16O2 and a molecular weight of 204.27 g/mol. Its IUPAC name is (2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol.

Molecular Properties

Compound Name(2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol
PubChem CID141197729
Molecular FormulaC13H16O2
Molecular Weight204.27 g/mol
Exact Mass204.12
IUPAC Name(2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol
SMILESOC[C@@H](Cc1ccccc1)[C@@H]1C=CCO1
InChIInChI=1S/C13H16O2/c14-10-12(13-7-4-8-15-13)9-11-5-2-1-3-6-11/h1-7,12-14H,8-10H2/t12-,13+/m1/s1
InChIKeyDVPDIGYKHVXURY-OLZOCXBDSA-N
XLogP1.79
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-cyclohexyl-3-phenylpropan-1-ol
CID 82936977
benzyl-[(2S)-2-[(2S)-2,5-dihydrofuran-2-yl]-3,3-difluoropropyl]carbamic acid
CID 67049065
2-(2-phenylethyl)-2,5-dihydrofuran
CID 15808466
1-[(2S)-oxiran-2-yl]-2-phenylethanol
CID 54466399
benzyl N-[(2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-2-methoxyethyl]carbamate
CID 91129411
1-(1,3-dioxolan-2-yl)-2-phenylethanol
CID 10241725
1-(oxolan-2-yl)-2-phenylethanol
CID 65331018
(2S)-2-(2-bromophenyl)-3-phenylpropan-1-ol
CID 86333738
(2S)-2-benzylbut-3-en-1-ol
CID 11084196
azane;2-benzyl-3-hydroxypropanoic acid
CID 70116076
N-(1-hydroxy-3-phenylpropan-2-yl)-1-(oxolan-2-yl)methanesulfonamide
CID 63261000
2-benzyl-3-(oxolan-2-yl)propanoic acid
CID 44719068

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol?
The IUPAC name of (2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol (CID 141197729) is (2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol.
What is the SMILES notation for (2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol?
The canonical SMILES for (2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol is OC[C@@H](Cc1ccccc1)[C@@H]1C=CCO1.
What is the InChIKey of (2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol?
The InChIKey is DVPDIGYKHVXURY-OLZOCXBDSA-N. The full InChI is InChI=1S/C13H16O2/c14-10-12(13-7-4-8-15-13)9-11-5-2-1-3-6-11/h1-7,12-14H,8-10H2/t12-,13+/m1/s1.
What are the key properties of (2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol?
(2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol has a molecular weight of 204.27 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2S)-2,5-dihydrofuran-2-yl]-3-phenylpropan-1-ol is sourced from PubChem (CID 141197729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).