(3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran

C11H17FO — CID 101403613

IUPAC(3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran
SMILESF[C@H]1C=C[C@@H](C2CCCCC2)OC1
InChIInChI=1S/C11H17FO/c12-10-6-7-11(13-8-10)9-4-2-1-3-5-9/h6-7,9-11H,1-5,8H2/t10-,11-/m0/s1
InChIKeyQAWDMVQLGBMAFF-QWRGUYRKSA-N
MW184.25 g/mol
LogP2.86
Rot. Bonds1

About (3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran

(3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran (PubChem CID 101403613) has the molecular formula C11H17FO and a molecular weight of 184.25 g/mol. Its IUPAC name is (3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran.

Molecular Properties

Compound Name(3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran
PubChem CID101403613
Molecular FormulaC11H17FO
Molecular Weight184.25 g/mol
Exact Mass184.13
IUPAC Name(3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran
SMILESF[C@H]1C=C[C@@H](C2CCCCC2)OC1
InChIInChI=1S/C11H17FO/c12-10-6-7-11(13-8-10)9-4-2-1-3-5-9/h6-7,9-11H,1-5,8H2/t10-,11-/m0/s1
InChIKeyQAWDMVQLGBMAFF-QWRGUYRKSA-N
XLogP2.86
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.25
LogP ≤ 52.86
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

4-chloro-6-cyclohexyl-3,6-dihydro-2H-pyran
CID 11183262
(2S,6R)-4-chloro-6-cyclohexyl-2-methyl-3,6-dihydro-2H-pyran
CID 44431632
3-(2,2,2-Trifluoro-1-prop-2-enoxyethyl)cyclohexene
CID 86077588
3-(1-Cyclohex-2-en-1-yloxy-2,2,2-trifluoroethyl)cyclohexene
CID 86077592
2-cyclohexyl-3,6-dihydro-2H-pyran
CID 11126643
2H-Pyran, 2-cyclohexyl-5,6-dihydro-
CID 11829812
[(Z,1S)-1-(2-methylprop-2-enoxy)but-2-enyl]cyclohexane
CID 11858809
2-Oxabicyclo[4.4.0]dec-9-ene
CID 68849332
(2R)-2-cyclohexyl-2,5-dihydrofuran
CID 118013458
2-[(E)-2-[4-(3,3-difluoroprop-2-enyl)cyclohexyl]ethenyl]-5-pentyloxane
CID 20599491
5-(2,2-difluoroethenyl)-2-[(E)-2-[4-[(E)-prop-1-enyl]cyclohexyl]ethenyl]oxane
CID 20599859
5-[4-[4-(2,2-difluoroethenyl)cyclohexyl]butyl]-2-[(E)-pent-1-enyl]oxane
CID 20599939

Frequently Asked Questions

What is the IUPAC name of (3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran?
The IUPAC name of (3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran (CID 101403613) is (3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran.
What is the SMILES notation for (3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran?
The canonical SMILES for (3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran is F[C@H]1C=C[C@@H](C2CCCCC2)OC1.
What is the InChIKey of (3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran?
The InChIKey is QAWDMVQLGBMAFF-QWRGUYRKSA-N. The full InChI is InChI=1S/C11H17FO/c12-10-6-7-11(13-8-10)9-4-2-1-3-5-9/h6-7,9-11H,1-5,8H2/t10-,11-/m0/s1.
What are the key properties of (3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran?
(3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran has a molecular weight of 184.25 g/mol, XLogP of 2.86, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,6R)-6-cyclohexyl-3-fluoro-3,6-dihydro-2H-pyran is sourced from PubChem (CID 101403613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).