3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol

C15H22N2O — CID 5255189

IUPAC3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol
SMILESCc1cc(C)c(N2C=CN(CCCO)C2)c(C)c1
InChIInChI=1S/C15H22N2O/c1-12-9-13(2)15(14(3)10-12)17-7-6-16(11-17)5-4-8-18/h6-7,9-10,18H,4-5,8,11H2,1-3H3
InChIKeyPOEIRMBDCOCHQG-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.54
Rot. Bonds4

About 3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol

3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol (PubChem CID 5255189) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol.

Molecular Properties

Compound Name3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol
PubChem CID5255189
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol
SMILESCc1cc(C)c(N2C=CN(CCCO)C2)c(C)c1
InChIInChI=1S/C15H22N2O/c1-12-9-13(2)15(14(3)10-12)17-7-6-16(11-17)5-4-8-18/h6-7,9-10,18H,4-5,8,11H2,1-3H3
InChIKeyPOEIRMBDCOCHQG-UHFFFAOYSA-N
XLogP2.54
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-octyl-3-(2,4,6-trimethylphenyl)-2H-imidazole;hydrobromide
CID 173052661
2-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]ethyl morpholine-4-carboxylate
CID 166009273
N-[2,6-di(propan-2-yl)phenyl]-2-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]acetamide
CID 171378161
4-(3-methyl-2H-imidazol-1-yl)butan-1-ol
CID 67438813
silver;1,3-bis(2,4,6-trimethylphenyl)-2H-imidazole;chlorogold;hexafluoroantimony(1-)
CID 18503829
triethoxy-[4-[[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]methyl]phenyl]silane
CID 91024187
3-(5,7-dimethyl-3,4-dihydro-2H-quinolin-1-yl)propan-1-ol
CID 110928546
2-(3-phenyl-2H-imidazol-1-yl)ethanol
CID 154061756
CID 139244845
CID 139244845
bis(2,3-dihydro-1-benzofuran-7-yl)-[[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]methyl]phosphane
CID 121442163
1-hexyl-3-(4-methylphenyl)-2H-imidazole
CID 123548074
CID 71475020
CID 71475020

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol?
The IUPAC name of 3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol (CID 5255189) is 3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol.
What is the SMILES notation for 3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol?
The canonical SMILES for 3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol is Cc1cc(C)c(N2C=CN(CCCO)C2)c(C)c1.
What is the InChIKey of 3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol?
The InChIKey is POEIRMBDCOCHQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-12-9-13(2)15(14(3)10-12)17-7-6-16(11-17)5-4-8-18/h6-7,9-10,18H,4-5,8,11H2,1-3H3.
What are the key properties of 3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol?
3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol has a molecular weight of 246.35 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-1-yl]propan-1-ol is sourced from PubChem (CID 5255189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).