5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol

C19H24O2 — CID 139655848

IUPAC5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol
SMILESCCc1cccc(Oc2ccc(CCCCCO)cc2)c1
InChIInChI=1S/C19H24O2/c1-2-16-8-6-9-19(15-16)21-18-12-10-17(11-13-18)7-4-3-5-14-20/h6,8-13,15,20H,2-5,7,14H2,1H3
InChIKeyLCUYRRYLCHDDQR-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.75
Rot. Bonds8

About 5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol

5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol (PubChem CID 139655848) has the molecular formula C19H24O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is 5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol.

Molecular Properties

Compound Name5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol
PubChem CID139655848
Molecular FormulaC19H24O2
Molecular Weight284.40 g/mol
Exact Mass284.18
IUPAC Name5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol
SMILESCCc1cccc(Oc2ccc(CCCCCO)cc2)c1
InChIInChI=1S/C19H24O2/c1-2-16-8-6-9-19(15-16)21-18-12-10-17(11-13-18)7-4-3-5-14-20/h6,8-13,15,20H,2-5,7,14H2,1H3
InChIKeyLCUYRRYLCHDDQR-UHFFFAOYSA-N
XLogP4.75
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-[4-(3-methylphenoxy)phenyl]pentan-1-ol
CID 139655740
6-(3-phenoxyphenyl)hexan-1-ol
CID 70473652
1-pentyl-3-(4-propylphenoxy)benzene
CID 58062247
1,3-bis(4-ethylphenoxy)benzene
CID 145452264
1-(3-iodopropyl)-3-(4-propylphenoxy)benzene
CID 25223077
1-fluoro-4-[3-(6-phenylhexyl)phenoxy]benzene
CID 58531395
1-phenoxy-3-(3-phenylpropyl)benzene
CID 173282204
N-[[3-(4-propylphenoxy)phenyl]methyl]ethanamine
CID 63942334
1-tetracosyl-4-(4-tetracosylphenoxy)benzene
CID 57157299
[2-chloro-4-(3-ethylphenoxy)phenyl]methanol
CID 114064321
1-methoxy-3-[2-[3-[4-[2-(4-methoxyphenyl)ethyl]phenoxy]phenyl]ethyl]benzene
CID 172870937
5-(3-propylphenoxy)pentan-1-ol
CID 174619714

Frequently Asked Questions

What is the IUPAC name of 5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol?
The IUPAC name of 5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol (CID 139655848) is 5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol.
What is the SMILES notation for 5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol?
The canonical SMILES for 5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol is CCc1cccc(Oc2ccc(CCCCCO)cc2)c1.
What is the InChIKey of 5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol?
The InChIKey is LCUYRRYLCHDDQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O2/c1-2-16-8-6-9-19(15-16)21-18-12-10-17(11-13-18)7-4-3-5-14-20/h6,8-13,15,20H,2-5,7,14H2,1H3.
What are the key properties of 5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol?
5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol has a molecular weight of 284.40 g/mol, XLogP of 4.75, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(3-ethylphenoxy)phenyl]pentan-1-ol is sourced from PubChem (CID 139655848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).