(3S)-3-methoxy-3,4-dihydro-2H-pyran

C6H10O2 — CID 28766515

IUPAC(3S)-3-methoxy-3,4-dihydro-2H-pyran
SMILESCO[C@H]1CC=COC1
InChIInChI=1S/C6H10O2/c1-7-6-3-2-4-8-5-6/h2,4,6H,3,5H2,1H3/t6-/m0/s1
InChIKeyUSEMLRYQCCWRGH-LURJTMIESA-N
MW114.14 g/mol
LogP0.94
Rot. Bonds1

About (3S)-3-methoxy-3,4-dihydro-2H-pyran

(3S)-3-methoxy-3,4-dihydro-2H-pyran (PubChem CID 28766515) has the molecular formula C6H10O2 and a molecular weight of 114.14 g/mol. Its IUPAC name is (3S)-3-methoxy-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Name(3S)-3-methoxy-3,4-dihydro-2H-pyran
PubChem CID28766515
Molecular FormulaC6H10O2
Molecular Weight114.14 g/mol
Exact Mass114.07
IUPAC Name(3S)-3-methoxy-3,4-dihydro-2H-pyran
SMILESCO[C@H]1CC=COC1
InChIInChI=1S/C6H10O2/c1-7-6-3-2-4-8-5-6/h2,4,6H,3,5H2,1H3/t6-/m0/s1
InChIKeyUSEMLRYQCCWRGH-LURJTMIESA-N
XLogP0.94
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.14
LogP ≤ 50.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3S)-3-methoxy-3,4-dihydro-2H-pyran?
The IUPAC name of (3S)-3-methoxy-3,4-dihydro-2H-pyran (CID 28766515) is (3S)-3-methoxy-3,4-dihydro-2H-pyran.
What is the SMILES notation for (3S)-3-methoxy-3,4-dihydro-2H-pyran?
The canonical SMILES for (3S)-3-methoxy-3,4-dihydro-2H-pyran is CO[C@H]1CC=COC1.
What is the InChIKey of (3S)-3-methoxy-3,4-dihydro-2H-pyran?
The InChIKey is USEMLRYQCCWRGH-LURJTMIESA-N. The full InChI is InChI=1S/C6H10O2/c1-7-6-3-2-4-8-5-6/h2,4,6H,3,5H2,1H3/t6-/m0/s1.
What are the key properties of (3S)-3-methoxy-3,4-dihydro-2H-pyran?
(3S)-3-methoxy-3,4-dihydro-2H-pyran has a molecular weight of 114.14 g/mol, XLogP of 0.94, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-methoxy-3,4-dihydro-2H-pyran is sourced from PubChem (CID 28766515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).