1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol

C16H24O2 — CID 103160577

IUPAC1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol
SMILESCCc1ccc(OCC(O)CC2CCCC2)cc1
InChIInChI=1S/C16H24O2/c1-2-13-7-9-16(10-8-13)18-12-15(17)11-14-5-3-4-6-14/h7-10,14-15,17H,2-6,11-12H2,1H3
InChIKeyCPRQFJZQHDSRHF-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.57
Rot. Bonds6

About 1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol

1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol (PubChem CID 103160577) has the molecular formula C16H24O2 and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol.

Molecular Properties

Compound Name1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol
PubChem CID103160577
Molecular FormulaC16H24O2
Molecular Weight248.37 g/mol
Exact Mass248.18
IUPAC Name1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol
SMILESCCc1ccc(OCC(O)CC2CCCC2)cc1
InChIInChI=1S/C16H24O2/c1-2-13-7-9-16(10-8-13)18-12-15(17)11-14-5-3-4-6-14/h7-10,14-15,17H,2-6,11-12H2,1H3
InChIKeyCPRQFJZQHDSRHF-UHFFFAOYSA-N
XLogP3.57
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-3-[4-(1-hydroxyethyl)phenoxy]propan-2-ol
CID 103158944
1-(cyclopentylamino)-3-(4-ethylphenoxy)propan-2-ol
CID 18838017
2-[4-(3-cyclopentyl-2-hydroxypropoxy)phenyl]acetonitrile
CID 103158515
methyl 4-(3-cyclopentyl-2-hydroxypropoxy)benzoate
CID 103156169
1-cyclopentyl-3-[4-(2-methylbutan-2-yl)phenoxy]propan-2-ol
CID 103160587
1-cyclopentyl-3-(4-ethyl-2-methoxyphenoxy)propan-2-ol
CID 103260703
1-(4-chlorophenoxy)-3-cyclobutylpropan-2-ol
CID 105100781
1-cyclopentyl-3-[4-[1-(ethylamino)ethyl]phenoxy]propan-2-ol
CID 103156424
2-[3-(4-ethylphenoxy)-2-hydroxypropyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 18087043
1-(4-ethylphenoxy)-3-(2-methylpiperidin-1-yl)propan-2-ol
CID 3395732
[(2S)-3-(4-ethylphenoxy)-2-hydroxypropyl]-trimethylazanium
CID 6940355
1-(cyclohexylmethoxy)-4-ethylbenzene
CID 58865018

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol?
The IUPAC name of 1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol (CID 103160577) is 1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol.
What is the SMILES notation for 1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol?
The canonical SMILES for 1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol is CCc1ccc(OCC(O)CC2CCCC2)cc1.
What is the InChIKey of 1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol?
The InChIKey is CPRQFJZQHDSRHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O2/c1-2-13-7-9-16(10-8-13)18-12-15(17)11-14-5-3-4-6-14/h7-10,14-15,17H,2-6,11-12H2,1H3.
What are the key properties of 1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol?
1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol has a molecular weight of 248.37 g/mol, XLogP of 3.57, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(4-ethylphenoxy)propan-2-ol is sourced from PubChem (CID 103160577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).