1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone

C11H10N2O2 — CID 84670621

IUPAC1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone
SMILESCC(=O)c1cncn1-c1ccc(O)cc1
InChIInChI=1S/C11H10N2O2/c1-8(14)11-6-12-7-13(11)9-2-4-10(15)5-3-9/h2-7,15H,1H3
InChIKeySAVFRPRNPPXWOJ-UHFFFAOYSA-N
MW202.21 g/mol
LogP1.78
Rot. Bonds2

About 1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone

1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone (PubChem CID 84670621) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is 1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone.

Molecular Properties

Compound Name1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone
PubChem CID84670621
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone
SMILESCC(=O)c1cncn1-c1ccc(O)cc1
InChIInChI=1S/C11H10N2O2/c1-8(14)11-6-12-7-13(11)9-2-4-10(15)5-3-9/h2-7,15H,1H3
InChIKeySAVFRPRNPPXWOJ-UHFFFAOYSA-N
XLogP1.78
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[5-(aminomethyl)imidazol-1-yl]phenol
CID 84662013
3-(4-fluorophenyl)imidazole-4-carbohydrazide
CID 5092120
4-[5-(2-aminoethyl)imidazol-1-yl]phenol
CID 84671540
N-ethyl-3-phenylimidazole-4-carboxamide
CID 47109591
2-methoxyethyl 3-(4-fluorophenyl)imidazole-4-carboxylate
CID 55475099
ethyl N-[[3-(4-fluorophenyl)imidazole-4-carbonyl]amino]carbamate
CID 43002854
N-(4-hydroxyphenyl)-N,3-dimethylimidazole-4-carboxamide
CID 103511122
3-phenyl-N-phenylmethoxyimidazole-4-carboxamide
CID 17426431
1-[4-[3-(4-fluorophenyl)imidazole-4-carbonyl]piperazin-1-yl]-2-methylpropan-1-one
CID 18159932
3-[4-[3,5-bis(trifluoromethyl)phenyl]phenyl]-N,N-dimethylimidazole-4-carboxamide
CID 46081531
N'-(4-ethylbenzoyl)-3-phenylimidazole-4-carbohydrazide
CID 30507763
azepan-1-yl-(3-phenylimidazol-4-yl)methanone
CID 60653934

Frequently Asked Questions

What is the IUPAC name of 1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone?
The IUPAC name of 1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone (CID 84670621) is 1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone.
What is the SMILES notation for 1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone?
The canonical SMILES for 1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone is CC(=O)c1cncn1-c1ccc(O)cc1.
What is the InChIKey of 1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone?
The InChIKey is SAVFRPRNPPXWOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c1-8(14)11-6-12-7-13(11)9-2-4-10(15)5-3-9/h2-7,15H,1H3.
What are the key properties of 1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone?
1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone has a molecular weight of 202.21 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(4-hydroxyphenyl)imidazol-4-yl]ethanone is sourced from PubChem (CID 84670621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).