6-ethyl-3,4,6-trimethyl-2,5-dihydropyran

C10H18O — CID 170599351

IUPAC6-ethyl-3,4,6-trimethyl-2,5-dihydropyran
SMILESCCC1(C)CC(C)=C(C)CO1
InChIInChI=1S/C10H18O/c1-5-10(4)6-8(2)9(3)7-11-10/h5-7H2,1-4H3
InChIKeyRYFHLCGXENJRGX-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.91
Rot. Bonds1

About 6-ethyl-3,4,6-trimethyl-2,5-dihydropyran

6-ethyl-3,4,6-trimethyl-2,5-dihydropyran (PubChem CID 170599351) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 6-ethyl-3,4,6-trimethyl-2,5-dihydropyran.

Molecular Properties

Compound Name6-ethyl-3,4,6-trimethyl-2,5-dihydropyran
PubChem CID170599351
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name6-ethyl-3,4,6-trimethyl-2,5-dihydropyran
SMILESCCC1(C)CC(C)=C(C)CO1
InChIInChI=1S/C10H18O/c1-5-10(4)6-8(2)9(3)7-11-10/h5-7H2,1-4H3
InChIKeyRYFHLCGXENJRGX-UHFFFAOYSA-N
XLogP2.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.91
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

2-Butyl-5,6-dihydro-2,4-dimethyl-2H-pyran
CID 3017306
2-Isopropyl-4-methyl-3,6-dihydro-2h-pyran
CID 12283089
3-Fluoro-4,6,6-trimethyl-2,5-dihydropyran
CID 168259915
3-Fluoro-6,6-dimethyl-4-propan-2-yl-2,5-dihydropyran
CID 176585480
3-Fluoro-5,6,6-trimethyl-4-propan-2-yl-2,5-dihydropyran
CID 177067982
3,6,6-Trimethyl-5-prop-2-enyl-2,3-dihydropyran
CID 11095002
(6S)-9-methyl-1-oxaspiro[5.5]undeca-3,9-diene
CID 11182804
(6R)-6-(2-methylpropyl)-6-prop-2-enyl-2,5-dihydropyran
CID 12103746
(5R)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene
CID 45091713
4-(2-Methylprop-2-enyl)-4-prop-2-enoxycyclopentene
CID 101200200
(5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene
CID 101200202
trans-2,2,3-Trimethyl-6-propyl-5,6-dihydropyran
CID 129788768

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-3,4,6-trimethyl-2,5-dihydropyran?
The IUPAC name of 6-ethyl-3,4,6-trimethyl-2,5-dihydropyran (CID 170599351) is 6-ethyl-3,4,6-trimethyl-2,5-dihydropyran.
What is the SMILES notation for 6-ethyl-3,4,6-trimethyl-2,5-dihydropyran?
The canonical SMILES for 6-ethyl-3,4,6-trimethyl-2,5-dihydropyran is CCC1(C)CC(C)=C(C)CO1.
What is the InChIKey of 6-ethyl-3,4,6-trimethyl-2,5-dihydropyran?
The InChIKey is RYFHLCGXENJRGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-5-10(4)6-8(2)9(3)7-11-10/h5-7H2,1-4H3.
What are the key properties of 6-ethyl-3,4,6-trimethyl-2,5-dihydropyran?
6-ethyl-3,4,6-trimethyl-2,5-dihydropyran has a molecular weight of 154.25 g/mol, XLogP of 2.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-3,4,6-trimethyl-2,5-dihydropyran is sourced from PubChem (CID 170599351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).