(6R)-6-methyl-6-phenyl-2,5-dihydropyran

C12H14O — CID 100966359

IUPAC(6R)-6-methyl-6-phenyl-2,5-dihydropyran
SMILESC[C@]1(c2ccccc2)CC=CCO1
InChIInChI=1S/C12H14O/c1-12(9-5-6-10-13-12)11-7-3-2-4-8-11/h2-8H,9-10H2,1H3/t12-/m1/s1
InChIKeyNIBDMTISQXIYFS-GFCCVEGCSA-N
MW174.24 g/mol
LogP2.88
Rot. Bonds1

About (6R)-6-methyl-6-phenyl-2,5-dihydropyran

(6R)-6-methyl-6-phenyl-2,5-dihydropyran (PubChem CID 100966359) has the molecular formula C12H14O and a molecular weight of 174.24 g/mol. Its IUPAC name is (6R)-6-methyl-6-phenyl-2,5-dihydropyran.

Molecular Properties

Compound Name(6R)-6-methyl-6-phenyl-2,5-dihydropyran
PubChem CID100966359
Molecular FormulaC12H14O
Molecular Weight174.24 g/mol
Exact Mass174.10
IUPAC Name(6R)-6-methyl-6-phenyl-2,5-dihydropyran
SMILESC[C@]1(c2ccccc2)CC=CCO1
InChIInChI=1S/C12H14O/c1-12(9-5-6-10-13-12)11-7-3-2-4-8-11/h2-8H,9-10H2,1H3/t12-/m1/s1
InChIKeyNIBDMTISQXIYFS-GFCCVEGCSA-N
XLogP2.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 52.88
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

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6-(2,5-dihydrofuran-2-yl)-6-phenyl-2,5-dihydropyran
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4-[(2R)-2-methyl-3H-furan-2-yl]benzonitrile
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3-methyl-3-phenyl-1,4-dihydroisochromen-1-ol
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4-methyl-4-phenyl-1,6-dioxaspiro[2.3]hexane
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CID 3657661

Frequently Asked Questions

What is the IUPAC name of (6R)-6-methyl-6-phenyl-2,5-dihydropyran?
The IUPAC name of (6R)-6-methyl-6-phenyl-2,5-dihydropyran (CID 100966359) is (6R)-6-methyl-6-phenyl-2,5-dihydropyran.
What is the SMILES notation for (6R)-6-methyl-6-phenyl-2,5-dihydropyran?
The canonical SMILES for (6R)-6-methyl-6-phenyl-2,5-dihydropyran is C[C@]1(c2ccccc2)CC=CCO1.
What is the InChIKey of (6R)-6-methyl-6-phenyl-2,5-dihydropyran?
The InChIKey is NIBDMTISQXIYFS-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H14O/c1-12(9-5-6-10-13-12)11-7-3-2-4-8-11/h2-8H,9-10H2,1H3/t12-/m1/s1.
What are the key properties of (6R)-6-methyl-6-phenyl-2,5-dihydropyran?
(6R)-6-methyl-6-phenyl-2,5-dihydropyran has a molecular weight of 174.24 g/mol, XLogP of 2.88, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-methyl-6-phenyl-2,5-dihydropyran is sourced from PubChem (CID 100966359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).