(2R,6R)-2-phenyl-6-prop-1-en-2-yloxane

C14H18O — CID 25232129

IUPAC(2R,6R)-2-phenyl-6-prop-1-en-2-yloxane
SMILESC=C(C)[C@H]1CCC[C@H](c2ccccc2)O1
InChIInChI=1S/C14H18O/c1-11(2)13-9-6-10-14(15-13)12-7-4-3-5-8-12/h3-5,7-8,13-14H,1,6,9-10H2,2H3/t13-,14-/m1/s1
InChIKeyAUFDHMCLZNPQFO-ZIAGYGMSSA-N
MW202.30 g/mol
LogP3.87
Rot. Bonds2

About (2R,6R)-2-phenyl-6-prop-1-en-2-yloxane

(2R,6R)-2-phenyl-6-prop-1-en-2-yloxane (PubChem CID 25232129) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is (2R,6R)-2-phenyl-6-prop-1-en-2-yloxane.

Molecular Properties

Compound Name(2R,6R)-2-phenyl-6-prop-1-en-2-yloxane
PubChem CID25232129
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name(2R,6R)-2-phenyl-6-prop-1-en-2-yloxane
SMILESC=C(C)[C@H]1CCC[C@H](c2ccccc2)O1
InChIInChI=1S/C14H18O/c1-11(2)13-9-6-10-14(15-13)12-7-4-3-5-8-12/h3-5,7-8,13-14H,1,6,9-10H2,2H3/t13-,14-/m1/s1
InChIKeyAUFDHMCLZNPQFO-ZIAGYGMSSA-N
XLogP3.87
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-[(6R)-6-phenyloxan-2-yl]propan-2-ol
CID 102038459
1-phenyl-2-(6-phenyloxan-2-yl)ethanone
CID 102133371
1-phenyl-2-[(2R,6S)-6-phenyloxan-2-yl]ethanone
CID 132849136
(6R)-2-(2-bromopropan-2-yl)-6-phenyloxane
CID 102038461
(2R,6S)-2-butyl-6-phenyloxane
CID 131845672
(2R,6S)-6-phenyloxane-2-carbonitrile
CID 58035350
(4S,5S)-4,5-diphenyl-2-prop-1-en-2-yl-1,3-dioxolane
CID 20637649
(2S,5S)-2-methyl-5-phenyloxolane
CID 71447018
(2S,5R)-2-ethyl-5-phenyloxolane
CID 102280065
(2R,3R)-2-phenyl-3-prop-1-en-2-yloxane
CID 134858494
1-[2-[(2R,6S)-6-phenyloxan-2-yl]ethyl]pyrrolidine
CID 164609782
(5-phenyloxolan-2-yl) acetate
CID 121009133

Frequently Asked Questions

What is the IUPAC name of (2R,6R)-2-phenyl-6-prop-1-en-2-yloxane?
The IUPAC name of (2R,6R)-2-phenyl-6-prop-1-en-2-yloxane (CID 25232129) is (2R,6R)-2-phenyl-6-prop-1-en-2-yloxane.
What is the SMILES notation for (2R,6R)-2-phenyl-6-prop-1-en-2-yloxane?
The canonical SMILES for (2R,6R)-2-phenyl-6-prop-1-en-2-yloxane is C=C(C)[C@H]1CCC[C@H](c2ccccc2)O1.
What is the InChIKey of (2R,6R)-2-phenyl-6-prop-1-en-2-yloxane?
The InChIKey is AUFDHMCLZNPQFO-ZIAGYGMSSA-N. The full InChI is InChI=1S/C14H18O/c1-11(2)13-9-6-10-14(15-13)12-7-4-3-5-8-12/h3-5,7-8,13-14H,1,6,9-10H2,2H3/t13-,14-/m1/s1.
What are the key properties of (2R,6R)-2-phenyl-6-prop-1-en-2-yloxane?
(2R,6R)-2-phenyl-6-prop-1-en-2-yloxane has a molecular weight of 202.30 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6R)-2-phenyl-6-prop-1-en-2-yloxane is sourced from PubChem (CID 25232129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).