cyclopropyl-(4-ethoxy-2-ethylphenyl)methanone

C14H18O2 — CID 82267347

IUPACcyclopropyl-(4-ethoxy-2-ethylphenyl)methanone
SMILESCCOc1ccc(C(=O)C2CC2)c(CC)c1
InChIInChI=1S/C14H18O2/c1-3-10-9-12(16-4-2)7-8-13(10)14(15)11-5-6-11/h7-9,11H,3-6H2,1-2H3
InChIKeyFGLZVOGOOBPEHA-UHFFFAOYSA-N
MW218.30 g/mol
LogP3.24
Rot. Bonds5

About cyclopropyl-(4-ethoxy-2-ethylphenyl)methanone

cyclopropyl-(4-ethoxy-2-ethylphenyl)methanone (PubChem CID 82267347) has the molecular formula C14H18O2 and a molecular weight of 218.30 g/mol. Its IUPAC name is cyclopropyl-(4-ethoxy-2-ethylphenyl)methanone.

Molecular Properties

Compound Namecyclopropyl-(4-ethoxy-2-ethylphenyl)methanone
PubChem CID82267347
Molecular FormulaC14H18O2
Molecular Weight218.30 g/mol
Exact Mass218.13
IUPAC Namecyclopropyl-(4-ethoxy-2-ethylphenyl)methanone
SMILESCCOc1ccc(C(=O)C2CC2)c(CC)c1
InChIInChI=1S/C14H18O2/c1-3-10-9-12(16-4-2)7-8-13(10)14(15)11-5-6-11/h7-9,11H,3-6H2,1-2H3
InChIKeyFGLZVOGOOBPEHA-UHFFFAOYSA-N
XLogP3.24
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-chloro-4-ethoxyphenyl)-cyclopropylmethanone
CID 82267627
cyclohexyl-(4-ethoxy-2-hydroxyphenyl)methanone
CID 12660809
(4-ethoxy-2-methylphenyl)-piperidin-3-ylmethanone
CID 82553697
(5-ethoxy-2-methoxyphenyl)-piperidin-4-ylmethanone
CID 82553003
[2-ethyl-5-(2-methylpropoxy)phenyl]-(4-methoxycyclohexyl)methanone
CID 126629458
(2-ethyl-4-methoxyphenyl)-piperidin-3-ylmethanone
CID 82552052
(E)-4-(4-ethoxy-2-ethylphenyl)hex-3-enoic acid
CID 83959100
(2-ethyl-4-propoxyphenyl)-pyrrolidin-2-ylmethanone
CID 82552016
(5-bromo-2-ethoxyphenyl)-cyclopropylmethanone
CID 43311304
cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanone
CID 82553608
2-[2-(4-ethoxy-2-ethylphenyl)ethyl]cyclopropane-1-carboxylic acid
CID 83941765
1-(2-bromo-4-ethoxyphenyl)-2-cycloheptylethanone
CID 114457392

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(4-ethoxy-2-ethylphenyl)methanone?
The IUPAC name of cyclopropyl-(4-ethoxy-2-ethylphenyl)methanone (CID 82267347) is cyclopropyl-(4-ethoxy-2-ethylphenyl)methanone.
What is the SMILES notation for cyclopropyl-(4-ethoxy-2-ethylphenyl)methanone?
The canonical SMILES for cyclopropyl-(4-ethoxy-2-ethylphenyl)methanone is CCOc1ccc(C(=O)C2CC2)c(CC)c1.
What is the InChIKey of cyclopropyl-(4-ethoxy-2-ethylphenyl)methanone?
The InChIKey is FGLZVOGOOBPEHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O2/c1-3-10-9-12(16-4-2)7-8-13(10)14(15)11-5-6-11/h7-9,11H,3-6H2,1-2H3.
What are the key properties of cyclopropyl-(4-ethoxy-2-ethylphenyl)methanone?
cyclopropyl-(4-ethoxy-2-ethylphenyl)methanone has a molecular weight of 218.30 g/mol, XLogP of 3.24, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(4-ethoxy-2-ethylphenyl)methanone is sourced from PubChem (CID 82267347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).