(1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol

C15H20N2O2 — CID 104934285

IUPAC(1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol
SMILESCc1ccc([C@@H](C)O)c(OCCc2nccn2C)c1
InChIInChI=1S/C15H20N2O2/c1-11-4-5-13(12(2)18)14(10-11)19-9-6-15-16-7-8-17(15)3/h4-5,7-8,10,12,18H,6,9H2,1-3H3/t12-/m1/s1
InChIKeyZPKRJMOLYNQVID-GFCCVEGCSA-N
MW260.34 g/mol
LogP2.40
Rot. Bonds5

About (1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol

(1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol (PubChem CID 104934285) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is (1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol
PubChem CID104934285
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name(1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol
SMILESCc1ccc([C@@H](C)O)c(OCCc2nccn2C)c1
InChIInChI=1S/C15H20N2O2/c1-11-4-5-13(12(2)18)14(10-11)19-9-6-15-16-7-8-17(15)3/h4-5,7-8,10,12,18H,6,9H2,1-3H3/t12-/m1/s1
InChIKeyZPKRJMOLYNQVID-GFCCVEGCSA-N
XLogP2.40
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 ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-methyl-4-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol
CID 114528382
(1S)-1-[3-methoxy-4-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol
CID 104934275
(1R)-1-[2-fluoro-4-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol
CID 107720209
1-[4-methyl-2-(2-pyridin-4-ylethoxy)phenyl]ethanol
CID 63650901
(1R)-1-[4-methyl-2-[(1-methylimidazol-2-yl)methoxy]phenyl]ethanamine
CID 63650710
(1R)-1-(4-methyl-2-propoxyphenyl)ethanol
CID 63650759
potassium trifluoro-[5-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]boranuide
CID 114528517
1-[4-methyl-2-(2-pyridin-3-ylethoxy)phenyl]ethanol
CID 63651512
(1R)-1-(2-butoxy-4-methylphenyl)ethanol
CID 63650593
(1R)-1-(4-methyl-2-nonoxyphenyl)ethanol
CID 78947128
(1S)-1-[2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]-4-methylphenyl]ethanol
CID 63650922
(1S)-1-[4-methyl-2-[(2-methyl-1,2,4-triazol-3-yl)methoxy]phenyl]ethanol
CID 79013751

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol?
The IUPAC name of (1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol (CID 104934285) is (1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol.
What is the SMILES notation for (1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol?
The canonical SMILES for (1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol is Cc1ccc([C@@H](C)O)c(OCCc2nccn2C)c1.
What is the InChIKey of (1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol?
The InChIKey is ZPKRJMOLYNQVID-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-11-4-5-13(12(2)18)14(10-11)19-9-6-15-16-7-8-17(15)3/h4-5,7-8,10,12,18H,6,9H2,1-3H3/t12-/m1/s1.
What are the key properties of (1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol?
(1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol has a molecular weight of 260.34 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol is sourced from PubChem (CID 104934285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).