1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone

C14H24O2 — CID 103167714

IUPAC1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone
SMILESCCOC1CC(CC(=O)C2CCCCC2)C1
InChIInChI=1S/C14H24O2/c1-2-16-13-8-11(9-13)10-14(15)12-6-4-3-5-7-12/h11-13H,2-10H2,1H3
InChIKeyTUVCISSZUNJPPL-UHFFFAOYSA-N
MW224.34 g/mol
LogP3.34
Rot. Bonds5

About 1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone

1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone (PubChem CID 103167714) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone.

Molecular Properties

Compound Name1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone
PubChem CID103167714
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone
SMILESCCOC1CC(CC(=O)C2CCCCC2)C1
InChIInChI=1S/C14H24O2/c1-2-16-13-8-11(9-13)10-14(15)12-6-4-3-5-7-12/h11-13H,2-10H2,1H3
InChIKeyTUVCISSZUNJPPL-UHFFFAOYSA-N
XLogP3.34
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclobutyl-2-(3-ethoxycyclobutyl)ethanone
CID 103168138
2-(3-ethoxycyclobutyl)-1-piperidin-1-ylethanone
CID 103164590
1-[2-(chloromethyl)azepan-1-yl]-2-(3-ethoxycyclobutyl)ethanone
CID 103166924
2-(3-ethoxycyclobutyl)-N-[(2S)-1-hydroxypropan-2-yl]acetamide
CID 103164701
1-[2-(3-ethoxycyclobutyl)acetyl]pyrrolidine-3-carboxylic acid
CID 103161885
N-[(4-chlorocyclohexyl)methyl]-2-(3-ethoxycyclobutyl)acetamide
CID 114147988
ethoxycyclooctane
CID 13427982
1-cyclohexyl-2-(3-methylcyclohexyl)oxyethanone
CID 104751838
N-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide
CID 103164593
methyl 4-(2-cyclopentyl-2-oxoethyl)cyclohexane-1-carboxylate
CID 130283512
azane;ethoxycyclooctane
CID 70271275
ethyl 8-cyclohexyl-8-oxooctanoate
CID 24727431

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone?
The IUPAC name of 1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone (CID 103167714) is 1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone.
What is the SMILES notation for 1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone?
The canonical SMILES for 1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone is CCOC1CC(CC(=O)C2CCCCC2)C1.
What is the InChIKey of 1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone?
The InChIKey is TUVCISSZUNJPPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c1-2-16-13-8-11(9-13)10-14(15)12-6-4-3-5-7-12/h11-13H,2-10H2,1H3.
What are the key properties of 1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone?
1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone has a molecular weight of 224.34 g/mol, XLogP of 3.34, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-(3-ethoxycyclobutyl)ethanone is sourced from PubChem (CID 103167714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).