1-(4-ethylcyclohexyl)oxy-3-fluorobenzene

C14H19FO — CID 64766217

IUPAC1-(4-ethylcyclohexyl)oxy-3-fluorobenzene
SMILESCCC1CCC(Oc2cccc(F)c2)CC1
InChIInChI=1S/C14H19FO/c1-2-11-6-8-13(9-7-11)16-14-5-3-4-12(15)10-14/h3-5,10-11,13H,2,6-9H2,1H3
InChIKeyNSFSYKPRRCXSFE-UHFFFAOYSA-N
MW222.30 g/mol
LogP4.17
Rot. Bonds3

About 1-(4-ethylcyclohexyl)oxy-3-fluorobenzene

1-(4-ethylcyclohexyl)oxy-3-fluorobenzene (PubChem CID 64766217) has the molecular formula C14H19FO and a molecular weight of 222.30 g/mol. Its IUPAC name is 1-(4-ethylcyclohexyl)oxy-3-fluorobenzene.

Molecular Properties

Compound Name1-(4-ethylcyclohexyl)oxy-3-fluorobenzene
PubChem CID64766217
Molecular FormulaC14H19FO
Molecular Weight222.30 g/mol
Exact Mass222.14
IUPAC Name1-(4-ethylcyclohexyl)oxy-3-fluorobenzene
SMILESCCC1CCC(Oc2cccc(F)c2)CC1
InChIInChI=1S/C14H19FO/c1-2-11-6-8-13(9-7-11)16-14-5-3-4-12(15)10-14/h3-5,10-11,13H,2,6-9H2,1H3
InChIKeyNSFSYKPRRCXSFE-UHFFFAOYSA-N
XLogP4.17
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.30
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-fluoro-3-(4-methylcyclohexyl)oxybenzene
CID 64764366
[4-(4-ethylcyclohexyl)oxy-2-fluorophenyl]boronic acid
CID 65203571
4-(3-fluorophenoxy)cyclohexan-1-one
CID 83702247
2-(4-ethylcyclohexyl)oxy-4-fluoro-1-methylbenzene
CID 102990440
1-fluoro-3-(3-methylcyclobutyl)oxybenzene
CID 142422559
1-(4-chlorobut-1-ynyl)-3-(4-ethylcyclohexyl)oxybenzene
CID 64774026
3-(3-fluorophenoxy)-1-methylazetidine
CID 118403576
2-[4-(3-fluorophenoxy)piperidin-1-yl]butanoic acid
CID 138037841
[4-(4-ethylcyclohexyl)oxyphenyl]boronic acid
CID 64747544
N-[(4-ethylcyclohexyl)methyl]-1-(3-fluorophenyl)propan-1-amine
CID 114871425
1-tert-butyl-4-(4-ethylcyclohexyl)oxybenzene
CID 64764201
6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 64748271

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylcyclohexyl)oxy-3-fluorobenzene?
The IUPAC name of 1-(4-ethylcyclohexyl)oxy-3-fluorobenzene (CID 64766217) is 1-(4-ethylcyclohexyl)oxy-3-fluorobenzene.
What is the SMILES notation for 1-(4-ethylcyclohexyl)oxy-3-fluorobenzene?
The canonical SMILES for 1-(4-ethylcyclohexyl)oxy-3-fluorobenzene is CCC1CCC(Oc2cccc(F)c2)CC1.
What is the InChIKey of 1-(4-ethylcyclohexyl)oxy-3-fluorobenzene?
The InChIKey is NSFSYKPRRCXSFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FO/c1-2-11-6-8-13(9-7-11)16-14-5-3-4-12(15)10-14/h3-5,10-11,13H,2,6-9H2,1H3.
What are the key properties of 1-(4-ethylcyclohexyl)oxy-3-fluorobenzene?
1-(4-ethylcyclohexyl)oxy-3-fluorobenzene has a molecular weight of 222.30 g/mol, XLogP of 4.17, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylcyclohexyl)oxy-3-fluorobenzene is sourced from PubChem (CID 64766217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).