[5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol

C13H16N2O — CID 105470027

IUPAC[5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol
SMILESCCc1[nH]c(CO)nc1-c1ccc(C)cc1
InChIInChI=1S/C13H16N2O/c1-3-11-13(15-12(8-16)14-11)10-6-4-9(2)5-7-10/h4-7,16H,3,8H2,1-2H3,(H,14,15)
InChIKeyGMTZMLDKSCOMBJ-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.44
Rot. Bonds3

About [5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol

[5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol (PubChem CID 105470027) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is [5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol.

Molecular Properties

Compound Name[5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol
PubChem CID105470027
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name[5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol
SMILESCCc1[nH]c(CO)nc1-c1ccc(C)cc1
InChIInChI=1S/C13H16N2O/c1-3-11-13(15-12(8-16)14-11)10-6-4-9(2)5-7-10/h4-7,16H,3,8H2,1-2H3,(H,14,15)
InChIKeyGMTZMLDKSCOMBJ-UHFFFAOYSA-N
XLogP2.44
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol
CID 105470026
4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol
CID 105454397
4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol
CID 105456043
6,7-diethyl-2,3-bis(4-methylphenyl)-5H-pyrrolo[2,3-b]pyrazine
CID 86690337
[4-(2-chlorophenyl)-5-ethyl-1H-imidazol-2-yl]methanol
CID 105498426
1-(5-ethyl-4-phenyl-1H-imidazol-2-yl)propan-2-amine
CID 60842488
(4,5-diphenyl-1H-imidazol-2-yl)methanol
CID 63926988
[3-(4-methylphenyl)-1H-1,2,4-triazol-5-yl]methanol
CID 79600441
(5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol
CID 105433907
[4-(4-ethylphenyl)-2-methyl-1H-imidazol-5-yl]methanamine
CID 82284727
ethanol;methanol;1,4-xylene
CID 70196397
5-ethyl-4-(3-methylphenyl)-1H-imidazole-2-carbaldehyde
CID 105467718

Frequently Asked Questions

What is the IUPAC name of [5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol?
The IUPAC name of [5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol (CID 105470027) is [5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol.
What is the SMILES notation for [5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol?
The canonical SMILES for [5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol is CCc1[nH]c(CO)nc1-c1ccc(C)cc1.
What is the InChIKey of [5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol?
The InChIKey is GMTZMLDKSCOMBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-3-11-13(15-12(8-16)14-11)10-6-4-9(2)5-7-10/h4-7,16H,3,8H2,1-2H3,(H,14,15).
What are the key properties of [5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol?
[5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol has a molecular weight of 216.28 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol is sourced from PubChem (CID 105470027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).