2-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-pyran

C14H18O — CID 72793122

IUPAC2-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-pyran
SMILESCc1cc(C)c(C2CCC=CO2)c(C)c1
InChIInChI=1S/C14H18O/c1-10-8-11(2)14(12(3)9-10)13-6-4-5-7-15-13/h5,7-9,13H,4,6H2,1-3H3
InChIKeyRMBKUACDIXHZTA-UHFFFAOYSA-N
MW202.30 g/mol
LogP3.98
Rot. Bonds1

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

2-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-pyran (PubChem CID 72793122) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Name2-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-pyran
PubChem CID72793122
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name2-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-pyran
SMILESCc1cc(C)c(C2CCC=CO2)c(C)c1
InChIInChI=1S/C14H18O/c1-10-8-11(2)14(12(3)9-10)13-6-4-5-7-15-13/h5,7-9,13H,4,6H2,1-3H3
InChIKeyRMBKUACDIXHZTA-UHFFFAOYSA-N
XLogP3.98
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-pyran?
The IUPAC name of 2-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-pyran (CID 72793122) is 2-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-pyran.
What is the SMILES notation for 2-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-pyran?
The canonical SMILES for 2-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-pyran is Cc1cc(C)c(C2CCC=CO2)c(C)c1.
What is the InChIKey of 2-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-pyran?
The InChIKey is RMBKUACDIXHZTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O/c1-10-8-11(2)14(12(3)9-10)13-6-4-5-7-15-13/h5,7-9,13H,4,6H2,1-3H3.
What are the key properties of 2-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-pyran?
2-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-pyran has a molecular weight of 202.30 g/mol, XLogP of 3.98, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-pyran is sourced from PubChem (CID 72793122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).