(2,6-dimethylphenyl)-(1H-imidazol-5-yl)methanol

C12H14N2O — CID 3061228

IUPAC(2,6-dimethylphenyl)-(1H-imidazol-5-yl)methanol
SMILESCc1cccc(C)c1C(O)c1cnc[nH]1
InChIInChI=1S/C12H14N2O/c1-8-4-3-5-9(2)11(8)12(15)10-6-13-7-14-10/h3-7,12,15H,1-2H3,(H,13,14)
InChIKeyOCHDQYRNWAVERA-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.11
Rot. Bonds2

About (2,6-dimethylphenyl)-(1H-imidazol-5-yl)methanol

(2,6-dimethylphenyl)-(1H-imidazol-5-yl)methanol (PubChem CID 3061228) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is (2,6-dimethylphenyl)-(1H-imidazol-5-yl)methanol.

Molecular Properties

Compound Name(2,6-dimethylphenyl)-(1H-imidazol-5-yl)methanol
PubChem CID3061228
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name(2,6-dimethylphenyl)-(1H-imidazol-5-yl)methanol
SMILESCc1cccc(C)c1C(O)c1cnc[nH]1
InChIInChI=1S/C12H14N2O/c1-8-4-3-5-9(2)11(8)12(15)10-6-13-7-14-10/h3-7,12,15H,1-2H3,(H,13,14)
InChIKeyOCHDQYRNWAVERA-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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Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylphenyl)-(1H-imidazol-5-yl)methanol?
The IUPAC name of (2,6-dimethylphenyl)-(1H-imidazol-5-yl)methanol (CID 3061228) is (2,6-dimethylphenyl)-(1H-imidazol-5-yl)methanol.
What is the SMILES notation for (2,6-dimethylphenyl)-(1H-imidazol-5-yl)methanol?
The canonical SMILES for (2,6-dimethylphenyl)-(1H-imidazol-5-yl)methanol is Cc1cccc(C)c1C(O)c1cnc[nH]1.
What is the InChIKey of (2,6-dimethylphenyl)-(1H-imidazol-5-yl)methanol?
The InChIKey is OCHDQYRNWAVERA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-8-4-3-5-9(2)11(8)12(15)10-6-13-7-14-10/h3-7,12,15H,1-2H3,(H,13,14).
What are the key properties of (2,6-dimethylphenyl)-(1H-imidazol-5-yl)methanol?
(2,6-dimethylphenyl)-(1H-imidazol-5-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 (2,6-dimethylphenyl)-(1H-imidazol-5-yl)methanol is sourced from PubChem (CID 3061228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).