5-ethyl-4-phenyl-3,6-dihydro-2H-pyran

C13H16O — CID 10899406

IUPAC5-ethyl-4-phenyl-3,6-dihydro-2H-pyran
SMILESCCC1=C(c2ccccc2)CCOC1
InChIInChI=1S/C13H16O/c1-2-11-10-14-9-8-13(11)12-6-4-3-5-7-12/h3-7H,2,8-10H2,1H3
InChIKeyXSFJNUIBNBEYRD-UHFFFAOYSA-N
MW188.27 g/mol
LogP3.27
Rot. Bonds2

About 5-ethyl-4-phenyl-3,6-dihydro-2H-pyran

5-ethyl-4-phenyl-3,6-dihydro-2H-pyran (PubChem CID 10899406) has the molecular formula C13H16O and a molecular weight of 188.27 g/mol. Its IUPAC name is 5-ethyl-4-phenyl-3,6-dihydro-2H-pyran.

Molecular Properties

Compound Name5-ethyl-4-phenyl-3,6-dihydro-2H-pyran
PubChem CID10899406
Molecular FormulaC13H16O
Molecular Weight188.27 g/mol
Exact Mass188.12
IUPAC Name5-ethyl-4-phenyl-3,6-dihydro-2H-pyran
SMILESCCC1=C(c2ccccc2)CCOC1
InChIInChI=1S/C13H16O/c1-2-11-10-14-9-8-13(11)12-6-4-3-5-7-12/h3-7H,2,8-10H2,1H3
InChIKeyXSFJNUIBNBEYRD-UHFFFAOYSA-N
XLogP3.27
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Styrene Oxide
CID 7276
Dibenzyl ether
CID 7657
(S)-styrene oxide
CID 114946
Methyl phenethyl ether
CID 19089
Phenylethyl tiglate
CID 5357002
Benzyl ethyl ether
CID 10873
Phenethyl senecioate
CID 61997
Benzyl butyl ether
CID 61134
Isoamyl phenethyl ether
CID 91978
Benzyl methyl ether
CID 10869
(+)-Styrene oxide
CID 114705
alpha-Amylcinnamyl formate
CID 6435834

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-phenyl-3,6-dihydro-2H-pyran?
The IUPAC name of 5-ethyl-4-phenyl-3,6-dihydro-2H-pyran (CID 10899406) is 5-ethyl-4-phenyl-3,6-dihydro-2H-pyran.
What is the SMILES notation for 5-ethyl-4-phenyl-3,6-dihydro-2H-pyran?
The canonical SMILES for 5-ethyl-4-phenyl-3,6-dihydro-2H-pyran is CCC1=C(c2ccccc2)CCOC1.
What is the InChIKey of 5-ethyl-4-phenyl-3,6-dihydro-2H-pyran?
The InChIKey is XSFJNUIBNBEYRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16O/c1-2-11-10-14-9-8-13(11)12-6-4-3-5-7-12/h3-7H,2,8-10H2,1H3.
What are the key properties of 5-ethyl-4-phenyl-3,6-dihydro-2H-pyran?
5-ethyl-4-phenyl-3,6-dihydro-2H-pyran has a molecular weight of 188.27 g/mol, XLogP of 3.27, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-phenyl-3,6-dihydro-2H-pyran is sourced from PubChem (CID 10899406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).