cyclooctyl-(3-cyclopropyloxyphenyl)methanone

C18H24O2 — CID 114521228

IUPACcyclooctyl-(3-cyclopropyloxyphenyl)methanone
SMILESO=C(c1cccc(OC2CC2)c1)C1CCCCCCC1
InChIInChI=1S/C18H24O2/c19-18(14-7-4-2-1-3-5-8-14)15-9-6-10-17(13-15)20-16-11-12-16/h6,9-10,13-14,16H,1-5,7-8,11-12H2
InChIKeyZVHDYLFEPAUGIG-UHFFFAOYSA-N
MW272.39 g/mol
LogP4.77
Rot. Bonds4

About cyclooctyl-(3-cyclopropyloxyphenyl)methanone

cyclooctyl-(3-cyclopropyloxyphenyl)methanone (PubChem CID 114521228) has the molecular formula C18H24O2 and a molecular weight of 272.39 g/mol. Its IUPAC name is cyclooctyl-(3-cyclopropyloxyphenyl)methanone.

Molecular Properties

Compound Namecyclooctyl-(3-cyclopropyloxyphenyl)methanone
PubChem CID114521228
Molecular FormulaC18H24O2
Molecular Weight272.39 g/mol
Exact Mass272.18
IUPAC Namecyclooctyl-(3-cyclopropyloxyphenyl)methanone
SMILESO=C(c1cccc(OC2CC2)c1)C1CCCCCCC1
InChIInChI=1S/C18H24O2/c19-18(14-7-4-2-1-3-5-8-14)15-9-6-10-17(13-15)20-16-11-12-16/h6,9-10,13-14,16H,1-5,7-8,11-12H2
InChIKeyZVHDYLFEPAUGIG-UHFFFAOYSA-N
XLogP4.77
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze cyclooctyl-(3-cyclopropyloxyphenyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cycloheptyl-(3-methoxyphenyl)methanone
CID 65399617
1-(3-cyclohexyloxyphenyl)ethanone
CID 43208744
[3-(cyclohexanecarbonyl)phenyl] acetate
CID 146010619
3-cyclopentyloxybenzamide
CID 71932153
(3-cyclopropyloxyphenyl)-(thiolan-2-yl)methanone
CID 114521229
(3-cyclopropyloxyphenyl)-(1-ethoxycyclohexyl)methanone
CID 114521280
3-cycloheptyloxybenzenecarbothioamide
CID 82927368
(3-cyclopropyloxyphenyl)-(1-methoxycycloheptyl)methanone
CID 114521285
(1-aminocyclobutyl)-(3-cyclopropyloxyphenyl)methanone
CID 114523853
cyclohexyl-(3-fluorophenyl)methanone
CID 24724195
1-(3-cyclopropyloxyphenyl)propan-1-one
CID 114521082
(3-amino-2-bicyclo[2.2.1]heptanyl)-(3-cyclopropyloxyphenyl)methanone
CID 114523789

Frequently Asked Questions

What is the IUPAC name of cyclooctyl-(3-cyclopropyloxyphenyl)methanone?
The IUPAC name of cyclooctyl-(3-cyclopropyloxyphenyl)methanone (CID 114521228) is cyclooctyl-(3-cyclopropyloxyphenyl)methanone.
What is the SMILES notation for cyclooctyl-(3-cyclopropyloxyphenyl)methanone?
The canonical SMILES for cyclooctyl-(3-cyclopropyloxyphenyl)methanone is O=C(c1cccc(OC2CC2)c1)C1CCCCCCC1.
What is the InChIKey of cyclooctyl-(3-cyclopropyloxyphenyl)methanone?
The InChIKey is ZVHDYLFEPAUGIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24O2/c19-18(14-7-4-2-1-3-5-8-14)15-9-6-10-17(13-15)20-16-11-12-16/h6,9-10,13-14,16H,1-5,7-8,11-12H2.
What are the key properties of cyclooctyl-(3-cyclopropyloxyphenyl)methanone?
cyclooctyl-(3-cyclopropyloxyphenyl)methanone has a molecular weight of 272.39 g/mol, XLogP of 4.77, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclooctyl-(3-cyclopropyloxyphenyl)methanone is sourced from PubChem (CID 114521228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).