1-(cyclohexylmethoxy)-3-ethylbenzene

C15H22O — CID 64765854

IUPAC1-(cyclohexylmethoxy)-3-ethylbenzene
SMILESCCc1cccc(OCC2CCCCC2)c1
InChIInChI=1S/C15H22O/c1-2-13-9-6-10-15(11-13)16-12-14-7-4-3-5-8-14/h6,9-11,14H,2-5,7-8,12H2,1H3
InChIKeyCRKNFTLYBAGXOB-UHFFFAOYSA-N
MW218.34 g/mol
LogP4.21
Rot. Bonds4

About 1-(cyclohexylmethoxy)-3-ethylbenzene

1-(cyclohexylmethoxy)-3-ethylbenzene (PubChem CID 64765854) has the molecular formula C15H22O and a molecular weight of 218.34 g/mol. Its IUPAC name is 1-(cyclohexylmethoxy)-3-ethylbenzene.

Molecular Properties

Compound Name1-(cyclohexylmethoxy)-3-ethylbenzene
PubChem CID64765854
Molecular FormulaC15H22O
Molecular Weight218.34 g/mol
Exact Mass218.17
IUPAC Name1-(cyclohexylmethoxy)-3-ethylbenzene
SMILESCCc1cccc(OCC2CCCCC2)c1
InChIInChI=1S/C15H22O/c1-2-13-9-6-10-15(11-13)16-12-14-7-4-3-5-8-14/h6,9-11,14H,2-5,7-8,12H2,1H3
InChIKeyCRKNFTLYBAGXOB-UHFFFAOYSA-N
XLogP4.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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1-(cyclohexylmethoxy)-4-ethylbenzene
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(4-ethylphenoxy)methylcycloheptane
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1-[3-(cyclobutylmethoxy)phenyl]propan-2-amine
CID 65459309
(3-ethylphenoxy)cyclooctane
CID 91220327
1-(cyclohexylmethoxy)-3-fluorobenzene
CID 60731171
1-[3-(cyclobutylmethoxy)phenyl]butan-2-amine
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3-[3-(cyclopentylmethoxy)phenyl]-N-methylpropan-1-amine
CID 170001159

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylmethoxy)-3-ethylbenzene?
The IUPAC name of 1-(cyclohexylmethoxy)-3-ethylbenzene (CID 64765854) is 1-(cyclohexylmethoxy)-3-ethylbenzene.
What is the SMILES notation for 1-(cyclohexylmethoxy)-3-ethylbenzene?
The canonical SMILES for 1-(cyclohexylmethoxy)-3-ethylbenzene is CCc1cccc(OCC2CCCCC2)c1.
What is the InChIKey of 1-(cyclohexylmethoxy)-3-ethylbenzene?
The InChIKey is CRKNFTLYBAGXOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O/c1-2-13-9-6-10-15(11-13)16-12-14-7-4-3-5-8-14/h6,9-11,14H,2-5,7-8,12H2,1H3.
What are the key properties of 1-(cyclohexylmethoxy)-3-ethylbenzene?
1-(cyclohexylmethoxy)-3-ethylbenzene has a molecular weight of 218.34 g/mol, XLogP of 4.21, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylmethoxy)-3-ethylbenzene is sourced from PubChem (CID 64765854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).