1-(3-cyclohexyloxyphenyl)ethanone

C14H18O2 — CID 43208744

IUPAC1-(3-cyclohexyloxyphenyl)ethanone
SMILESCC(=O)c1cccc(OC2CCCCC2)c1
InChIInChI=1S/C14H18O2/c1-11(15)12-6-5-9-14(10-12)16-13-7-3-2-4-8-13/h5-6,9-10,13H,2-4,7-8H2,1H3
InChIKeyOCYCTUUWMHCUQI-UHFFFAOYSA-N
MW218.30 g/mol
LogP3.60
Rot. Bonds3

About 1-(3-cyclohexyloxyphenyl)ethanone

1-(3-cyclohexyloxyphenyl)ethanone (PubChem CID 43208744) has the molecular formula C14H18O2 and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-(3-cyclohexyloxyphenyl)ethanone.

Molecular Properties

Compound Name1-(3-cyclohexyloxyphenyl)ethanone
PubChem CID43208744
Molecular FormulaC14H18O2
Molecular Weight218.30 g/mol
Exact Mass218.13
IUPAC Name1-(3-cyclohexyloxyphenyl)ethanone
SMILESCC(=O)c1cccc(OC2CCCCC2)c1
InChIInChI=1S/C14H18O2/c1-11(15)12-6-5-9-14(10-12)16-13-7-3-2-4-8-13/h5-6,9-10,13H,2-4,7-8H2,1H3
InChIKeyOCYCTUUWMHCUQI-UHFFFAOYSA-N
XLogP3.60
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(7-cyclononyloxycyclodeca-1,3,5,7,9-pentaen-1-yl)ethanone
CID 91060627
3-cyclopentyloxybenzamide
CID 71932153
cyclooctyl-(3-cyclopropyloxyphenyl)methanone
CID 114521228
(3-acetylphenyl) cyclohexanecarboxylate
CID 86975498
3-cycloheptyloxybenzenecarbothioamide
CID 82927368
2-[(3-cyclopentyloxybenzoyl)-methylamino]acetic acid
CID 119171827
2-(3-acetylphenoxy)-1-cyclohexylethanone
CID 115582273
1-(3-cyclopropyloxyphenyl)propan-1-one
CID 114521082
(3-methylphenoxy)cyclononane
CID 145391482
(3-cyclopropyloxyphenyl)-(1-methoxycycloheptyl)methanone
CID 114521285
3-cyclopentyloxy-N-(1,3-dihydroxy-2-methylpropan-2-yl)benzamide
CID 122141053
1-(3-cyclopropyloxyphenyl)-2-(methylamino)propan-1-one
CID 114523725

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclohexyloxyphenyl)ethanone?
The IUPAC name of 1-(3-cyclohexyloxyphenyl)ethanone (CID 43208744) is 1-(3-cyclohexyloxyphenyl)ethanone.
What is the SMILES notation for 1-(3-cyclohexyloxyphenyl)ethanone?
The canonical SMILES for 1-(3-cyclohexyloxyphenyl)ethanone is CC(=O)c1cccc(OC2CCCCC2)c1.
What is the InChIKey of 1-(3-cyclohexyloxyphenyl)ethanone?
The InChIKey is OCYCTUUWMHCUQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O2/c1-11(15)12-6-5-9-14(10-12)16-13-7-3-2-4-8-13/h5-6,9-10,13H,2-4,7-8H2,1H3.
What are the key properties of 1-(3-cyclohexyloxyphenyl)ethanone?
1-(3-cyclohexyloxyphenyl)ethanone has a molecular weight of 218.30 g/mol, XLogP of 3.60, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclohexyloxyphenyl)ethanone is sourced from PubChem (CID 43208744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).