(2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone

C18H20O2 — CID 63496404

IUPAC(2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone
SMILESCCOc1ccc(C)cc1C(=O)c1cc(C)ccc1C
InChIInChI=1S/C18H20O2/c1-5-20-17-9-7-13(3)11-16(17)18(19)15-10-12(2)6-8-14(15)4/h6-11H,5H2,1-4H3
InChIKeyFFMDGYFNEKKLEG-UHFFFAOYSA-N
MW268.36 g/mol
LogP4.24
Rot. Bonds4

About (2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone

(2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone (PubChem CID 63496404) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is (2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone.

Molecular Properties

Compound Name(2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone
PubChem CID63496404
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name(2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone
SMILESCCOc1ccc(C)cc1C(=O)c1cc(C)ccc1C
InChIInChI=1S/C18H20O2/c1-5-20-17-9-7-13(3)11-16(17)18(19)15-10-12(2)6-8-14(15)4/h6-11H,5H2,1-4H3
InChIKeyFFMDGYFNEKKLEG-UHFFFAOYSA-N
XLogP4.24
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-bromo-5-methylphenyl)-(2-ethoxy-5-methylphenyl)methanone
CID 81110926
(3-bromo-4-ethoxyphenyl)-(2,5-dimethylphenyl)methanone
CID 104656758
(3-chloro-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanone
CID 107096172
N-(2-aminoethyl)-2-ethoxy-5-methylbenzamide
CID 84613985
(5-bromothiophen-2-yl)-(2-ethoxy-5-methylphenyl)methanone
CID 63496583
(5-chlorofuran-2-yl)-(2-ethoxy-5-methylphenyl)methanone
CID 106683820
(4,5-dibromothiophen-2-yl)-(2-ethoxy-5-methylphenyl)methanone
CID 80536132
(2-ethoxy-5-methylphenyl)-pyridin-3-ylmethanone
CID 115000096
(2-amino-6-methoxyphenyl)-(2-ethoxy-5-methylphenyl)methanone
CID 81397099
(4-chloro-3-fluorophenyl)-(2-ethoxy-5-methylphenyl)methanone
CID 107998309
1-(2-ethoxy-5-methylphenyl)prop-1-ene-1,2-dithiol
CID 72543160
N-(4-ethoxy-3-methoxyphenyl)-2,5-dimethylbenzamide
CID 9100356

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone?
The IUPAC name of (2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone (CID 63496404) is (2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone.
What is the SMILES notation for (2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone?
The canonical SMILES for (2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone is CCOc1ccc(C)cc1C(=O)c1cc(C)ccc1C.
What is the InChIKey of (2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone?
The InChIKey is FFMDGYFNEKKLEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c1-5-20-17-9-7-13(3)11-16(17)18(19)15-10-12(2)6-8-14(15)4/h6-11H,5H2,1-4H3.
What are the key properties of (2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone?
(2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone has a molecular weight of 268.36 g/mol, XLogP of 4.24, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone is sourced from PubChem (CID 63496404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).