3-ethyl-3,4-dimethyl-2,2-diphenyloxetane

C19H22O — CID 165355883

IUPAC3-ethyl-3,4-dimethyl-2,2-diphenyloxetane
SMILESCCC1(C)C(C)OC1(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H22O/c1-4-18(3)15(2)20-19(18,16-11-7-5-8-12-16)17-13-9-6-10-14-17/h5-15H,4H2,1-3H3
InChIKeyYEJHVOOBGRUZOE-UHFFFAOYSA-N
MW266.38 g/mol
LogP4.77
Rot. Bonds3

About 3-ethyl-3,4-dimethyl-2,2-diphenyloxetane

3-ethyl-3,4-dimethyl-2,2-diphenyloxetane (PubChem CID 165355883) has the molecular formula C19H22O and a molecular weight of 266.38 g/mol. Its IUPAC name is 3-ethyl-3,4-dimethyl-2,2-diphenyloxetane.

Molecular Properties

Compound Name3-ethyl-3,4-dimethyl-2,2-diphenyloxetane
PubChem CID165355883
Molecular FormulaC19H22O
Molecular Weight266.38 g/mol
Exact Mass266.17
IUPAC Name3-ethyl-3,4-dimethyl-2,2-diphenyloxetane
SMILESCCC1(C)C(C)OC1(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H22O/c1-4-18(3)15(2)20-19(18,16-11-7-5-8-12-16)17-13-9-6-10-14-17/h5-15H,4H2,1-3H3
InChIKeyYEJHVOOBGRUZOE-UHFFFAOYSA-N
XLogP4.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3,4-dimethyl-2,2-diphenyloxetane?
The IUPAC name of 3-ethyl-3,4-dimethyl-2,2-diphenyloxetane (CID 165355883) is 3-ethyl-3,4-dimethyl-2,2-diphenyloxetane.
What is the SMILES notation for 3-ethyl-3,4-dimethyl-2,2-diphenyloxetane?
The canonical SMILES for 3-ethyl-3,4-dimethyl-2,2-diphenyloxetane is CCC1(C)C(C)OC1(c1ccccc1)c1ccccc1.
What is the InChIKey of 3-ethyl-3,4-dimethyl-2,2-diphenyloxetane?
The InChIKey is YEJHVOOBGRUZOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O/c1-4-18(3)15(2)20-19(18,16-11-7-5-8-12-16)17-13-9-6-10-14-17/h5-15H,4H2,1-3H3.
What are the key properties of 3-ethyl-3,4-dimethyl-2,2-diphenyloxetane?
3-ethyl-3,4-dimethyl-2,2-diphenyloxetane has a molecular weight of 266.38 g/mol, XLogP of 4.77, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3,4-dimethyl-2,2-diphenyloxetane is sourced from PubChem (CID 165355883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).