(3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran

C11H16O — CID 143913732

IUPAC(3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran
SMILESC=CC1=C(C=C)OC[C@H](CC)C1
InChIInChI=1S/C11H16O/c1-4-9-7-10(5-2)11(6-3)12-8-9/h5-6,9H,2-4,7-8H2,1H3/t9-/m1/s1
InChIKeyUSOJNPCQVNCIPK-SECBINFHSA-N
MW164.25 g/mol
LogP3.06
Rot. Bonds3

About (3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran

(3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran (PubChem CID 143913732) has the molecular formula C11H16O and a molecular weight of 164.25 g/mol. Its IUPAC name is (3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Name(3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran
PubChem CID143913732
Molecular FormulaC11H16O
Molecular Weight164.25 g/mol
Exact Mass164.12
IUPAC Name(3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran
SMILESC=CC1=C(C=C)OC[C@H](CC)C1
InChIInChI=1S/C11H16O/c1-4-9-7-10(5-2)11(6-3)12-8-9/h5-6,9H,2-4,7-8H2,1H3/t9-/m1/s1
InChIKeyUSOJNPCQVNCIPK-SECBINFHSA-N
XLogP3.06
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran?
The IUPAC name of (3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran (CID 143913732) is (3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran.
What is the SMILES notation for (3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran?
The canonical SMILES for (3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran is C=CC1=C(C=C)OC[C@H](CC)C1.
What is the InChIKey of (3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran?
The InChIKey is USOJNPCQVNCIPK-SECBINFHSA-N. The full InChI is InChI=1S/C11H16O/c1-4-9-7-10(5-2)11(6-3)12-8-9/h5-6,9H,2-4,7-8H2,1H3/t9-/m1/s1.
What are the key properties of (3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran?
(3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran has a molecular weight of 164.25 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-5,6-bis(ethenyl)-3-ethyl-3,4-dihydro-2H-pyran is sourced from PubChem (CID 143913732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).