[2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol

C12H14N2O — CID 63108319

IUPAC[2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol
SMILESCc1ccc(-c2ncc(CO)[nH]2)cc1C
InChIInChI=1S/C12H14N2O/c1-8-3-4-10(5-9(8)2)12-13-6-11(7-15)14-12/h3-6,15H,7H2,1-2H3,(H,13,14)
InChIKeyFGJJVPNENVQVIU-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.19
Rot. Bonds2

About [2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol

[2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol (PubChem CID 63108319) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is [2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol
PubChem CID63108319
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name[2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol
SMILESCc1ccc(-c2ncc(CO)[nH]2)cc1C
InChIInChI=1S/C12H14N2O/c1-8-3-4-10(5-9(8)2)12-13-6-11(7-15)14-12/h3-6,15H,7H2,1-2H3,(H,13,14)
InChIKeyFGJJVPNENVQVIU-UHFFFAOYSA-N
XLogP2.19
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol?
The IUPAC name of [2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol (CID 63108319) is [2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol.
What is the SMILES notation for [2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol?
The canonical SMILES for [2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol is Cc1ccc(-c2ncc(CO)[nH]2)cc1C.
What is the InChIKey of [2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol?
The InChIKey is FGJJVPNENVQVIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-8-3-4-10(5-9(8)2)12-13-6-11(7-15)14-12/h3-6,15H,7H2,1-2H3,(H,13,14).
What are the key properties of [2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol?
[2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol has a molecular weight of 202.26 g/mol, XLogP of 2.19, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,4-dimethylphenyl)-1H-imidazol-5-yl]methanol is sourced from PubChem (CID 63108319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).