(1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol

C15H20N2O4 — CID 2890298

IUPAC(1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol
SMILESCCn1ccnc1C(O)c1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C15H20N2O4/c1-5-17-7-6-16-15(17)13(18)10-8-11(19-2)14(21-4)12(9-10)20-3/h6-9,13,18H,5H2,1-4H3
InChIKeyFHLAHWUKZNUUDJ-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.01
Rot. Bonds6

About (1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol

(1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol (PubChem CID 2890298) has the molecular formula C15H20N2O4 and a molecular weight of 292.34 g/mol. Its IUPAC name is (1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol.

Molecular Properties

Compound Name(1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol
PubChem CID2890298
Molecular FormulaC15H20N2O4
Molecular Weight292.34 g/mol
Exact Mass292.14
IUPAC Name(1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol
SMILESCCn1ccnc1C(O)c1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C15H20N2O4/c1-5-17-7-6-16-15(17)13(18)10-8-11(19-2)14(21-4)12(9-10)20-3/h6-9,13,18H,5H2,1-4H3
InChIKeyFHLAHWUKZNUUDJ-UHFFFAOYSA-N
XLogP2.01
TPSA65.74 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(1-ethylimidazol-2-yl)-(6-methoxynaphthalen-2-yl)methanol
CID 63976278
(2,5-dimethoxyphenyl)-(1-ethylimidazol-2-yl)methanol
CID 3140475
(3,4-difluorophenyl)-(1-ethylimidazol-2-yl)methanol
CID 61314221
(1-ethylimidazol-2-yl)-pyridazin-4-ylmethanol
CID 104672120
(1-ethylimidazol-2-yl)-(3-iodophenyl)methanol
CID 61315347
N-[(1-ethylimidazol-2-yl)methyl]-3,4,5-trimethoxyaniline
CID 62356027
1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol
CID 79616649
(3-methoxyphenyl)-(1-propylimidazol-2-yl)methanol
CID 61317073
(3,5-dimethyl-2-pyridinyl)-(1-ethylimidazol-2-yl)methanol
CID 113365556
(4-bromo-3,5-dimethylphenyl)-(1-propylimidazol-2-yl)methanol
CID 114329829
(6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-(1-ethylimidazol-2-yl)methanol
CID 63976688
N-[(1-ethylimidazol-2-yl)-(4-fluoro-3-methoxyphenyl)methyl]propan-1-amine
CID 81289391

Frequently Asked Questions

What is the IUPAC name of (1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol?
The IUPAC name of (1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol (CID 2890298) is (1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol.
What is the SMILES notation for (1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol?
The canonical SMILES for (1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol is CCn1ccnc1C(O)c1cc(OC)c(OC)c(OC)c1.
What is the InChIKey of (1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol?
The InChIKey is FHLAHWUKZNUUDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-5-17-7-6-16-15(17)13(18)10-8-11(19-2)14(21-4)12(9-10)20-3/h6-9,13,18H,5H2,1-4H3.
What are the key properties of (1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol?
(1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol has a molecular weight of 292.34 g/mol, XLogP of 2.01, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylimidazol-2-yl)-(3,4,5-trimethoxyphenyl)methanol is sourced from PubChem (CID 2890298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).