1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol

C15H20N2O2 — CID 63974584

IUPAC1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol
SMILESCCCn1ccnc1C(C)(O)c1cccc(OC)c1
InChIInChI=1S/C15H20N2O2/c1-4-9-17-10-8-16-14(17)15(2,18)12-6-5-7-13(11-12)19-3/h5-8,10-11,18H,4,9H2,1-3H3
InChIKeyITOOQBDOKWZFOK-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.56
Rot. Bonds5

About 1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol

1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol (PubChem CID 63974584) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol
PubChem CID63974584
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol
SMILESCCCn1ccnc1C(C)(O)c1cccc(OC)c1
InChIInChI=1S/C15H20N2O2/c1-4-9-17-10-8-16-14(17)15(2,18)12-6-5-7-13(11-12)19-3/h5-8,10-11,18H,4,9H2,1-3H3
InChIKeyITOOQBDOKWZFOK-UHFFFAOYSA-N
XLogP2.56
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 ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-methoxyphenyl)-(1-propylimidazol-2-yl)methanol
CID 61317073
(1S)-1-(3-methoxyphenyl)-1-phenylethanol
CID 29415940
1-(3-methoxyphenyl)-1-phenylethanol
CID 15680503
3-(1-propylimidazol-2-yl)pentan-3-ol
CID 63974999
1-(3-methoxyphenyl)-1-(2-propoxyphenyl)ethanol
CID 104658498
(2S,3S)-2,3-bis(3-methoxyphenyl)butane-2,3-diol
CID 101270093
2-phenyl-1-(1-propylimidazol-2-yl)propan-2-ol
CID 79744122
1-(3,4-dimethoxyphenyl)-1-(3-methoxyphenyl)ethanol
CID 62787623
1-(3-methoxyphenyl)-1-naphthalen-2-ylethanol
CID 62787792
1-fluoro-1-(3-methoxyphenyl)ethanol
CID 174577353
2-(3-methoxyphenyl)-3-methylhexan-2-ol
CID 107892511
1-(3-methoxyphenyl)-1-quinolin-3-ylethanol
CID 60924847

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol?
The IUPAC name of 1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol (CID 63974584) is 1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol.
What is the SMILES notation for 1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol?
The canonical SMILES for 1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol is CCCn1ccnc1C(C)(O)c1cccc(OC)c1.
What is the InChIKey of 1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol?
The InChIKey is ITOOQBDOKWZFOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-9-17-10-8-16-14(17)15(2,18)12-6-5-7-13(11-12)19-3/h5-8,10-11,18H,4,9H2,1-3H3.
What are the key properties of 1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol?
1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol has a molecular weight of 260.34 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-1-(1-propylimidazol-2-yl)ethanol is sourced from PubChem (CID 63974584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).