4-ethyl-3-methyl-2-propan-2-yldibenzofuran

C18H20O — CID 144782623

IUPAC4-ethyl-3-methyl-2-propan-2-yldibenzofuran
SMILESCCc1c(C)c(C(C)C)cc2c1oc1ccccc12
InChIInChI=1S/C18H20O/c1-5-13-12(4)15(11(2)3)10-16-14-8-6-7-9-17(14)19-18(13)16/h6-11H,5H2,1-4H3
InChIKeyVVMROLURALAGEE-UHFFFAOYSA-N
MW252.36 g/mol
LogP5.58
Rot. Bonds2

About 4-ethyl-3-methyl-2-propan-2-yldibenzofuran

4-ethyl-3-methyl-2-propan-2-yldibenzofuran (PubChem CID 144782623) has the molecular formula C18H20O and a molecular weight of 252.36 g/mol. Its IUPAC name is 4-ethyl-3-methyl-2-propan-2-yldibenzofuran.

Molecular Properties

Compound Name4-ethyl-3-methyl-2-propan-2-yldibenzofuran
PubChem CID144782623
Molecular FormulaC18H20O
Molecular Weight252.36 g/mol
Exact Mass252.15
IUPAC Name4-ethyl-3-methyl-2-propan-2-yldibenzofuran
SMILESCCc1c(C)c(C(C)C)cc2c1oc1ccccc12
InChIInChI=1S/C18H20O/c1-5-13-12(4)15(11(2)3)10-16-14-8-6-7-9-17(14)19-18(13)16/h6-11H,5H2,1-4H3
InChIKeyVVMROLURALAGEE-UHFFFAOYSA-N
XLogP5.58
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500252.36
LogP ≤ 55.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-methyl-2-propan-2-yldibenzofuran?
The IUPAC name of 4-ethyl-3-methyl-2-propan-2-yldibenzofuran (CID 144782623) is 4-ethyl-3-methyl-2-propan-2-yldibenzofuran.
What is the SMILES notation for 4-ethyl-3-methyl-2-propan-2-yldibenzofuran?
The canonical SMILES for 4-ethyl-3-methyl-2-propan-2-yldibenzofuran is CCc1c(C)c(C(C)C)cc2c1oc1ccccc12.
What is the InChIKey of 4-ethyl-3-methyl-2-propan-2-yldibenzofuran?
The InChIKey is VVMROLURALAGEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O/c1-5-13-12(4)15(11(2)3)10-16-14-8-6-7-9-17(14)19-18(13)16/h6-11H,5H2,1-4H3.
What are the key properties of 4-ethyl-3-methyl-2-propan-2-yldibenzofuran?
4-ethyl-3-methyl-2-propan-2-yldibenzofuran has a molecular weight of 252.36 g/mol, XLogP of 5.58, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-methyl-2-propan-2-yldibenzofuran is sourced from PubChem (CID 144782623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).