[5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol

C13H16N2O — CID 105470026

IUPAC[5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol
SMILESCCc1[nH]c(CO)nc1-c1cccc(C)c1
InChIInChI=1S/C13H16N2O/c1-3-11-13(15-12(8-16)14-11)10-6-4-5-9(2)7-10/h4-7,16H,3,8H2,1-2H3,(H,14,15)
InChIKeyZPPWEPVZGALLSM-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.44
Rot. Bonds3

About [5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol

[5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol (PubChem CID 105470026) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is [5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol.

Molecular Properties

Compound Name[5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol
PubChem CID105470026
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name[5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol
SMILESCCc1[nH]c(CO)nc1-c1cccc(C)c1
InChIInChI=1S/C13H16N2O/c1-3-11-13(15-12(8-16)14-11)10-6-4-5-9(2)7-10/h4-7,16H,3,8H2,1-2H3,(H,14,15)
InChIKeyZPPWEPVZGALLSM-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-(4-methylphenyl)-1H-imidazol-2-yl]methanol
CID 105470027
5-ethyl-4-(3-methylphenyl)-1H-imidazole-2-carbaldehyde
CID 105467718
[4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol
CID 82428598
4-(3-methylphenyl)-5-[3-[5-(3-methylphenyl)-2H-triazol-4-yl]phenyl]-2H-triazole
CID 118532825
2-ethyl-6-(3-methylphenyl)-1H-pyrimidine-4-thione
CID 106515355
1-(5-ethyl-4-phenyl-1H-imidazol-2-yl)propan-2-amine
CID 60842488
4-(3-methylphenyl)-5-(5-methyl-1H-pyrrol-3-yl)-2H-triazole
CID 142183458
ethyl 2-bromo-4-(3-methylphenyl)-1,3-thiazole-5-carboxylate
CID 131867355
5-ethyl-4-(3-methylphenyl)-1,3-thiazole-2-carbaldehyde
CID 105489991
2-ethyl-N,5-dimethyl-6-(3-methylphenyl)pyrimidin-4-amine
CID 80975057
2,3-diethyl-5-(3-methylphenyl)imidazol-4-amine
CID 62225267
[3-(3-methylphenyl)-4-pyridinyl]methanol
CID 130118995

Frequently Asked Questions

What is the IUPAC name of [5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol?
The IUPAC name of [5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol (CID 105470026) is [5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol.
What is the SMILES notation for [5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol?
The canonical SMILES for [5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol is CCc1[nH]c(CO)nc1-c1cccc(C)c1.
What is the InChIKey of [5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol?
The InChIKey is ZPPWEPVZGALLSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-3-11-13(15-12(8-16)14-11)10-6-4-5-9(2)7-10/h4-7,16H,3,8H2,1-2H3,(H,14,15).
What are the key properties of [5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol?
[5-ethyl-4-(3-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-(3-methylphenyl)-1H-imidazol-2-yl]methanol is sourced from PubChem (CID 105470026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).