4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran

C14H18O — CID 102376463

IUPAC4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran
SMILESCC1=CC(CCc2ccccc2)OCC1
InChIInChI=1S/C14H18O/c1-12-9-10-15-14(11-12)8-7-13-5-3-2-4-6-13/h2-6,11,14H,7-10H2,1H3
InChIKeyZKAQNEUXSRUGRY-UHFFFAOYSA-N
MW202.30 g/mol
LogP3.35
Rot. Bonds3

About 4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran

4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran (PubChem CID 102376463) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is 4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran.

Molecular Properties

Compound Name4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran
PubChem CID102376463
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran
SMILESCC1=CC(CCc2ccccc2)OCC1
InChIInChI=1S/C14H18O/c1-12-9-10-15-14(11-12)8-7-13-5-3-2-4-6-13/h2-6,11,14H,7-10H2,1H3
InChIKeyZKAQNEUXSRUGRY-UHFFFAOYSA-N
XLogP3.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran?
The IUPAC name of 4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran (CID 102376463) is 4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran.
What is the SMILES notation for 4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran?
The canonical SMILES for 4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran is CC1=CC(CCc2ccccc2)OCC1.
What is the InChIKey of 4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran?
The InChIKey is ZKAQNEUXSRUGRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O/c1-12-9-10-15-14(11-12)8-7-13-5-3-2-4-6-13/h2-6,11,14H,7-10H2,1H3.
What are the key properties of 4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran?
4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran has a molecular weight of 202.30 g/mol, XLogP of 3.35, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-(2-phenylethyl)-3,6-dihydro-2H-pyran is sourced from PubChem (CID 102376463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).