1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol

C15H22O2 — CID 103986414

IUPAC1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol
SMILESCCc1ccc(CC(O)CC2CCOC2)cc1
InChIInChI=1S/C15H22O2/c1-2-12-3-5-13(6-4-12)9-15(16)10-14-7-8-17-11-14/h3-6,14-16H,2,7-11H2,1H3
InChIKeyDJHZLUKRVHBKKF-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.58
Rot. Bonds5

About 1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol

1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol (PubChem CID 103986414) has the molecular formula C15H22O2 and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol.

Molecular Properties

Compound Name1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol
PubChem CID103986414
Molecular FormulaC15H22O2
Molecular Weight234.34 g/mol
Exact Mass234.16
IUPAC Name1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol
SMILESCCc1ccc(CC(O)CC2CCOC2)cc1
InChIInChI=1S/C15H22O2/c1-2-12-3-5-13(6-4-12)9-15(16)10-14-7-8-17-11-14/h3-6,14-16H,2,7-11H2,1H3
InChIKeyDJHZLUKRVHBKKF-UHFFFAOYSA-N
XLogP2.58
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-ethylphenyl)-N-methyl-3-(oxolan-3-yl)propan-2-amine
CID 113362150
1-(oxolan-3-yl)-3-pyridin-3-ylpropan-2-ol
CID 104736202
1-(4-ethylphenoxy)-3-(oxolan-3-ylmethylamino)propan-2-ol
CID 61039219
1-(3,4-dimethylphenyl)-3-(oxan-4-yl)propan-2-ol
CID 62899788
N-[1-(4-ethylphenyl)-2-(oxolan-3-yl)ethyl]propan-1-amine
CID 103987410
1-(2-bromo-5-methoxyphenyl)-3-(oxolan-3-yl)propan-2-ol
CID 103986427
1-(3-chloro-4-pyridinyl)-3-(oxolan-3-yl)propan-2-ol
CID 103986580
1-(4-amino-3-pyridinyl)-3-(oxolan-3-yl)propan-2-ol
CID 103986436
1-(1,4-dioxan-2-yl)-2-(4-ethylphenyl)ethanol
CID 65350862
1-(oxolan-3-yl)-3-quinolin-2-ylpropan-2-ol
CID 103986478
2-(4-ethylphenoxy)-1-(oxolan-3-yl)ethanol
CID 113449273
1-(5-ethyl-2-pyridinyl)-N-methyl-3-(oxolan-3-yl)propan-2-amine
CID 103987022

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol?
The IUPAC name of 1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol (CID 103986414) is 1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol.
What is the SMILES notation for 1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol?
The canonical SMILES for 1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol is CCc1ccc(CC(O)CC2CCOC2)cc1.
What is the InChIKey of 1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol?
The InChIKey is DJHZLUKRVHBKKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O2/c1-2-12-3-5-13(6-4-12)9-15(16)10-14-7-8-17-11-14/h3-6,14-16H,2,7-11H2,1H3.
What are the key properties of 1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol?
1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol has a molecular weight of 234.34 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylphenyl)-3-(oxolan-3-yl)propan-2-ol is sourced from PubChem (CID 103986414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).