2-(2-ethylphenoxy)-1-phenylethanol

C16H18O2 — CID 60731173

IUPAC2-(2-ethylphenoxy)-1-phenylethanol
SMILESCCc1ccccc1OCC(O)c1ccccc1
InChIInChI=1S/C16H18O2/c1-2-13-8-6-7-11-16(13)18-12-15(17)14-9-4-3-5-10-14/h3-11,15,17H,2,12H2,1H3
InChIKeyPNHMNSNKEANMBZ-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.36
Rot. Bonds5

About 2-(2-ethylphenoxy)-1-phenylethanol

2-(2-ethylphenoxy)-1-phenylethanol (PubChem CID 60731173) has the molecular formula C16H18O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-(2-ethylphenoxy)-1-phenylethanol.

Molecular Properties

Compound Name2-(2-ethylphenoxy)-1-phenylethanol
PubChem CID60731173
Molecular FormulaC16H18O2
Molecular Weight242.32 g/mol
Exact Mass242.13
IUPAC Name2-(2-ethylphenoxy)-1-phenylethanol
SMILESCCc1ccccc1OCC(O)c1ccccc1
InChIInChI=1S/C16H18O2/c1-2-13-8-6-7-11-16(13)18-12-15(17)14-9-4-3-5-10-14/h3-11,15,17H,2,12H2,1H3
InChIKeyPNHMNSNKEANMBZ-UHFFFAOYSA-N
XLogP3.36
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-ethoxyphenoxy)-1-phenylethanol
CID 60730563
1-phenyl-2-[2-(propylaminomethyl)phenoxy]ethanol
CID 60881782
2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride
CID 162317712
3-(2-ethylphenoxy)-2-phenylpropan-1-amine
CID 112516482
2-[2-(1-aminoethyl)phenoxy]-1-phenylethanol
CID 60878238
1-(2-ethylphenoxy)-3-(methylamino)propan-2-ol
CID 43173825
1-(2,2-dimethoxyethoxy)-2-ethylbenzene
CID 66223177
3-(2-ethylphenoxy)-2-methylpropanamide
CID 64765862
2-[2-(hydroxymethyl)phenoxy]-1-(3-methoxyphenyl)ethanol
CID 81134038
benzene;2-methoxy-1-phenylethanol
CID 174622919
5-(2-ethylphenoxy)pentanoic acid
CID 43351498
2-[(2-ethylphenoxy)methyl]-3,3-dimethylbutane-1-sulfonamide
CID 65015190

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylphenoxy)-1-phenylethanol?
The IUPAC name of 2-(2-ethylphenoxy)-1-phenylethanol (CID 60731173) is 2-(2-ethylphenoxy)-1-phenylethanol.
What is the SMILES notation for 2-(2-ethylphenoxy)-1-phenylethanol?
The canonical SMILES for 2-(2-ethylphenoxy)-1-phenylethanol is CCc1ccccc1OCC(O)c1ccccc1.
What is the InChIKey of 2-(2-ethylphenoxy)-1-phenylethanol?
The InChIKey is PNHMNSNKEANMBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2/c1-2-13-8-6-7-11-16(13)18-12-15(17)14-9-4-3-5-10-14/h3-11,15,17H,2,12H2,1H3.
What are the key properties of 2-(2-ethylphenoxy)-1-phenylethanol?
2-(2-ethylphenoxy)-1-phenylethanol has a molecular weight of 242.32 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylphenoxy)-1-phenylethanol is sourced from PubChem (CID 60731173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).