2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol

C17H26O2 — CID 104658729

IUPAC2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol
SMILESCCCOc1ccccc1C1(O)CCCCC1CC
InChIInChI=1S/C17H26O2/c1-3-13-19-16-11-6-5-10-15(16)17(18)12-8-7-9-14(17)4-2/h5-6,10-11,14,18H,3-4,7-9,12-13H2,1-2H3
InChIKeyDPGVJXUQNNIPSK-UHFFFAOYSA-N
MW262.39 g/mol
LogP4.26
Rot. Bonds5

About 2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol

2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol (PubChem CID 104658729) has the molecular formula C17H26O2 and a molecular weight of 262.39 g/mol. Its IUPAC name is 2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol.

Molecular Properties

Compound Name2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol
PubChem CID104658729
Molecular FormulaC17H26O2
Molecular Weight262.39 g/mol
Exact Mass262.19
IUPAC Name2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol
SMILESCCCOc1ccccc1C1(O)CCCCC1CC
InChIInChI=1S/C17H26O2/c1-3-13-19-16-11-6-5-10-15(16)17(18)12-8-7-9-14(17)4-2/h5-6,10-11,14,18H,3-4,7-9,12-13H2,1-2H3
InChIKeyDPGVJXUQNNIPSK-UHFFFAOYSA-N
XLogP4.26
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.39
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol?
The IUPAC name of 2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol (CID 104658729) is 2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol.
What is the SMILES notation for 2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol?
The canonical SMILES for 2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol is CCCOc1ccccc1C1(O)CCCCC1CC.
What is the InChIKey of 2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol?
The InChIKey is DPGVJXUQNNIPSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O2/c1-3-13-19-16-11-6-5-10-15(16)17(18)12-8-7-9-14(17)4-2/h5-6,10-11,14,18H,3-4,7-9,12-13H2,1-2H3.
What are the key properties of 2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol?
2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol has a molecular weight of 262.39 g/mol, XLogP of 4.26, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-(2-propoxyphenyl)cyclohexan-1-ol is sourced from PubChem (CID 104658729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).