(3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol

C13H16N2O2 — CID 66135157

IUPAC(3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol
SMILESCCn1cncc1C(O)c1cccc(OC)c1
InChIInChI=1S/C13H16N2O2/c1-3-15-9-14-8-12(15)13(16)10-5-4-6-11(7-10)17-2/h4-9,13,16H,3H2,1-2H3
InChIKeyWSMNAMQJJRQDRN-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.99
Rot. Bonds4

About (3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol

(3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol (PubChem CID 66135157) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is (3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol.

Molecular Properties

Compound Name(3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol
PubChem CID66135157
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name(3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol
SMILESCCn1cncc1C(O)c1cccc(OC)c1
InChIInChI=1S/C13H16N2O2/c1-3-15-9-14-8-12(15)13(16)10-5-4-6-11(7-10)17-2/h4-9,13,16H,3H2,1-2H3
InChIKeyWSMNAMQJJRQDRN-UHFFFAOYSA-N
XLogP1.99
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-cyclopropyloxyphenyl)-(3-ethylimidazol-4-yl)methanol
CID 114520938
2-(3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol
CID 66131044
(3,4-diethoxyphenyl)-(3-ethylimidazol-4-yl)methanol
CID 66134131
N-[(3-ethylimidazol-4-yl)methyl]-1-(3-methoxyphenyl)ethanamine
CID 66133621
(1R)-N-[(3-ethylimidazol-4-yl)methyl]-1-(3-methoxyphenyl)ethanamine
CID 81376063
methyl 2-(3-ethylimidazol-4-yl)-2-(3-methoxyanilino)acetate
CID 66132458
(3-methoxyphenyl)-(3-phenyltriazol-4-yl)methanol
CID 114684694
(3-methylimidazol-4-yl)-[3-(trifluoromethoxy)phenyl]methanol
CID 66118408
(R)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methanol
CID 97293101
(5-chloro-2-methoxyphenyl)-(3-ethylimidazol-4-yl)methanol
CID 66135362
(3-methoxyphenyl)-(1-propylimidazol-2-yl)methanol
CID 61317073
(3-ethylimidazol-4-yl)-isoquinolin-8-ylmethanol
CID 103142939

Frequently Asked Questions

What is the IUPAC name of (3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol?
The IUPAC name of (3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol (CID 66135157) is (3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol.
What is the SMILES notation for (3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol?
The canonical SMILES for (3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol is CCn1cncc1C(O)c1cccc(OC)c1.
What is the InChIKey of (3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol?
The InChIKey is WSMNAMQJJRQDRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-3-15-9-14-8-12(15)13(16)10-5-4-6-11(7-10)17-2/h4-9,13,16H,3H2,1-2H3.
What are the key properties of (3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol?
(3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol has a molecular weight of 232.28 g/mol, XLogP of 1.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylimidazol-4-yl)-(3-methoxyphenyl)methanol is sourced from PubChem (CID 66135157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).