2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole

C16H12N4O — CID 56917189

IUPAC2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole
SMILESc1coc(-c2nccn2-c2ccc(-c3ccn[nH]3)cc2)c1
InChIInChI=1S/C16H12N4O/c1-2-15(21-11-1)16-17-9-10-20(16)13-5-3-12(4-6-13)14-7-8-18-19-14/h1-11H,(H,18,19)
InChIKeyZBDKNLLQECEXDP-UHFFFAOYSA-N
MW276.30 g/mol
LogP3.52
Rot. Bonds3

About 2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole

2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole (PubChem CID 56917189) has the molecular formula C16H12N4O and a molecular weight of 276.30 g/mol. Its IUPAC name is 2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole.

Molecular Properties

Compound Name2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole
PubChem CID56917189
Molecular FormulaC16H12N4O
Molecular Weight276.30 g/mol
Exact Mass276.10
IUPAC Name2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole
SMILESc1coc(-c2nccn2-c2ccc(-c3ccn[nH]3)cc2)c1
InChIInChI=1S/C16H12N4O/c1-2-15(21-11-1)16-17-9-10-20(16)13-5-3-12(4-6-13)14-7-8-18-19-14/h1-11H,(H,18,19)
InChIKeyZBDKNLLQECEXDP-UHFFFAOYSA-N
XLogP3.52
TPSA59.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.30
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

8-(Furan-2-yl)-3-[2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]ethyl]-[1,2,4]triazolo[5,1-f]purin-5-amine
CID 10203891
3-(2-fluorophenyl)-7-(furan-2-yl)-2-((2-methyl-2H-1,2,4-triazol-3-yl)methoxy)pyrazolo[1,5-d][1,2,4]triazine
CID 18406903
4-(Furan-2-yl)-10-[2-(4-pyrazin-2-ylphenyl)ethyl]-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine
CID 21363905
2-[4-[2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]ethyl]-N-(2-hydroxyethyl)anilino]ethanol
CID 10026670
10-[3-(4-Aminophenyl)propyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine
CID 10904839
7-(Furan-2-ylmethyl)-3-(3-imidazol-1-ylpropyl)-5,6-diphenylpyrrolo[2,3-d]pyrimidin-4-imine
CID 1312086
7-(furan-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)-5,6-diphenylpyrrolo[2,3-d]pyrimidin-4-amine
CID 2930286
2-Furan-2-yl-6-(4-trifluoromethyl-phenyl)-[1,2,4]triazolo[1,5-a]pyrazin-8-ylamine
CID 11233248
3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin-6-yl)-benzonitrile
CID 11243564
1-[3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin-6-yl)-phenyl]-ethanone
CID 11359069
7-(2-Furyl)-3-(5-indazolylmethyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine-5-amine
CID 21874662
N-[3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin-6-yl)-phenyl]-acetamide
CID 44216145

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole?
The IUPAC name of 2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole (CID 56917189) is 2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole.
What is the SMILES notation for 2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole?
The canonical SMILES for 2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole is c1coc(-c2nccn2-c2ccc(-c3ccn[nH]3)cc2)c1.
What is the InChIKey of 2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole?
The InChIKey is ZBDKNLLQECEXDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4O/c1-2-15(21-11-1)16-17-9-10-20(16)13-5-3-12(4-6-13)14-7-8-18-19-14/h1-11H,(H,18,19).
What are the key properties of 2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole?
2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole has a molecular weight of 276.30 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole is sourced from PubChem (CID 56917189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).