2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol

C15H20N2O2 — CID 115819361

IUPAC2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol
SMILESCCn1ccnc1CC(O)c1cc(C)ccc1OC
InChIInChI=1S/C15H20N2O2/c1-4-17-8-7-16-15(17)10-13(18)12-9-11(2)5-6-14(12)19-3/h5-9,13,18H,4,10H2,1-3H3
InChIKeyHLJJWNCJTCSKPX-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.50
Rot. Bonds5

About 2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol

2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol (PubChem CID 115819361) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol
PubChem CID115819361
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol
SMILESCCn1ccnc1CC(O)c1cc(C)ccc1OC
InChIInChI=1S/C15H20N2O2/c1-4-17-8-7-16-15(17)10-13(18)12-9-11(2)5-6-14(12)19-3/h5-9,13,18H,4,10H2,1-3H3
InChIKeyHLJJWNCJTCSKPX-UHFFFAOYSA-N
XLogP2.50
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol?
The IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol (CID 115819361) is 2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol.
What is the SMILES notation for 2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol?
The canonical SMILES for 2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol is CCn1ccnc1CC(O)c1cc(C)ccc1OC.
What is the InChIKey of 2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol?
The InChIKey is HLJJWNCJTCSKPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-17-8-7-16-15(17)10-13(18)12-9-11(2)5-6-14(12)19-3/h5-9,13,18H,4,10H2,1-3H3.
What are the key properties of 2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol?
2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol has a molecular weight of 260.34 g/mol, XLogP of 2.50, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol is sourced from PubChem (CID 115819361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).