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

C12H14N2O — CID 112724089

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

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

(3,4-dimethylphenyl)-(1H-imidazol-2-yl)methanol (PubChem CID 112724089) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is (3,4-dimethylphenyl)-(1H-imidazol-2-yl)methanol.

Molecular Properties

Compound Name(3,4-dimethylphenyl)-(1H-imidazol-2-yl)methanol
PubChem CID112724089
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name(3,4-dimethylphenyl)-(1H-imidazol-2-yl)methanol
SMILESCc1ccc(C(O)c2ncc[nH]2)cc1C
InChIInChI=1S/C12H14N2O/c1-8-3-4-10(7-9(8)2)11(15)12-13-5-6-14-12/h3-7,11,15H,1-2H3,(H,13,14)
InChIKeyZHHDEXBTJASCPC-UHFFFAOYSA-N
XLogP2.11
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 ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-dimethylphenyl)-2-(1H-imidazol-2-yl)ethanol
CID 61083210
(3-fluorophenyl)-(1H-imidazol-2-yl)methanol
CID 66771409
2-[2-bromo-2-(3,4-dimethylphenyl)ethyl]-1H-imidazole
CID 61096174
2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol
CID 68678189
(R)-(3,4-dimethylphenyl)-pyridin-2-ylmethanol
CID 94481789
(S)-(3,4-dimethylphenyl)-pyridin-2-ylmethanol
CID 94481788
(3,4-dimethylphenyl)-(1H-pyrrol-3-yl)methanol
CID 63749459
(2-fluoro-4,6-dimethylphenyl)-(1H-imidazol-2-yl)methanol
CID 106881131
2-(3,4-dimethylphenyl)-1H-imidazole
CID 12622727
(3,4-dimethylphenyl)-(4-methyl-3-pyridinyl)methanol
CID 66274356
1H-imidazol-2-yl-(2-methylthiophen-3-yl)methanol
CID 102831477
(3,4-dimethylphenyl)-(3,5-dimethyl-2-pyridinyl)methanol
CID 113365534

Frequently Asked Questions

What is the IUPAC name of (3,4-dimethylphenyl)-(1H-imidazol-2-yl)methanol?
The IUPAC name of (3,4-dimethylphenyl)-(1H-imidazol-2-yl)methanol (CID 112724089) is (3,4-dimethylphenyl)-(1H-imidazol-2-yl)methanol.
What is the SMILES notation for (3,4-dimethylphenyl)-(1H-imidazol-2-yl)methanol?
The canonical SMILES for (3,4-dimethylphenyl)-(1H-imidazol-2-yl)methanol is Cc1ccc(C(O)c2ncc[nH]2)cc1C.
What is the InChIKey of (3,4-dimethylphenyl)-(1H-imidazol-2-yl)methanol?
The InChIKey is ZHHDEXBTJASCPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-8-3-4-10(7-9(8)2)11(15)12-13-5-6-14-12/h3-7,11,15H,1-2H3,(H,13,14).
What are the key properties of (3,4-dimethylphenyl)-(1H-imidazol-2-yl)methanol?
(3,4-dimethylphenyl)-(1H-imidazol-2-yl)methanol has a molecular weight of 202.26 g/mol, XLogP of 2.11, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dimethylphenyl)-(1H-imidazol-2-yl)methanol is sourced from PubChem (CID 112724089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).