3-(4-methylimidazol-1-yl)phenol

C10H10N2O — CID 10241285

IUPAC3-(4-methylimidazol-1-yl)phenol
SMILESCc1cn(-c2cccc(O)c2)cn1
InChIInChI=1S/C10H10N2O/c1-8-6-12(7-11-8)9-3-2-4-10(13)5-9/h2-7,13H,1H3
InChIKeyXPEBJVAMQTZLCP-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.89
Rot. Bonds1

About 3-(4-methylimidazol-1-yl)phenol

3-(4-methylimidazol-1-yl)phenol (PubChem CID 10241285) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 3-(4-methylimidazol-1-yl)phenol.

Molecular Properties

Compound Name3-(4-methylimidazol-1-yl)phenol
PubChem CID10241285
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name3-(4-methylimidazol-1-yl)phenol
SMILESCc1cn(-c2cccc(O)c2)cn1
InChIInChI=1S/C10H10N2O/c1-8-6-12(7-11-8)9-3-2-4-10(13)5-9/h2-7,13H,1H3
InChIKeyXPEBJVAMQTZLCP-UHFFFAOYSA-N
XLogP1.89
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(p-Hydroxyphenyl)imidazole
CID 82315
1-Phenyl-5-hydroxybenzimidazole
CID 667662
1-Phenylbenzimidazole deriv. 27
CID 5328438
1-Phenylbenzimidazole deriv. 77
CID 5328475
N-(3-hydroxyphenyl)-2-(1-methylimidazol-2-yl)sulfanylacetamide
CID 581967
[3-(4-Methylimidazol-1-yl)phenyl] sulfamate;hydrochloride
CID 45262284
Sulfamic acid 3-(1H-imidazol-1-yl)phenyl ester monohydrochloride
CID 45262292
Sulfamic acid 3-(2-methyl-1H-imidazol-1-yl)-phenyl ester monohydrochloride
CID 45262295
1-Methyl-1H-benzo[d]imidazol-5-ol
CID 840445
2-(1H-Imidazol-1-yl)phenol
CID 12913249
3-[(1-Methyl-4-nitro-1H-imidazol-5-yl)amino]phenol
CID 536031
1,2-dimethyl-1H-1,3-benzodiazol-5-ol
CID 658535

Frequently Asked Questions

What is the IUPAC name of 3-(4-methylimidazol-1-yl)phenol?
The IUPAC name of 3-(4-methylimidazol-1-yl)phenol (CID 10241285) is 3-(4-methylimidazol-1-yl)phenol.
What is the SMILES notation for 3-(4-methylimidazol-1-yl)phenol?
The canonical SMILES for 3-(4-methylimidazol-1-yl)phenol is Cc1cn(-c2cccc(O)c2)cn1.
What is the InChIKey of 3-(4-methylimidazol-1-yl)phenol?
The InChIKey is XPEBJVAMQTZLCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-8-6-12(7-11-8)9-3-2-4-10(13)5-9/h2-7,13H,1H3.
What are the key properties of 3-(4-methylimidazol-1-yl)phenol?
3-(4-methylimidazol-1-yl)phenol has a molecular weight of 174.20 g/mol, XLogP of 1.89, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylimidazol-1-yl)phenol is sourced from PubChem (CID 10241285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).