1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole

C18H16N4O — CID 56879404

IUPAC1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole
SMILESc1coc(CCn2ccnc2-c2ccc(-n3cccn3)cc2)c1
InChIInChI=1S/C18H16N4O/c1-3-17(23-14-1)8-12-21-13-10-19-18(21)15-4-6-16(7-5-15)22-11-2-9-20-22/h1-7,9-11,13-14H,8,12H2
InChIKeyDSNLEFOKDHSZQI-UHFFFAOYSA-N
MW304.35 g/mol
LogP3.57
Rot. Bonds5

About 1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole

1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole (PubChem CID 56879404) has the molecular formula C18H16N4O and a molecular weight of 304.35 g/mol. Its IUPAC name is 1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole.

Molecular Properties

Compound Name1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole
PubChem CID56879404
Molecular FormulaC18H16N4O
Molecular Weight304.35 g/mol
Exact Mass304.13
IUPAC Name1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole
SMILESc1coc(CCn2ccnc2-c2ccc(-n3cccn3)cc2)c1
InChIInChI=1S/C18H16N4O/c1-3-17(23-14-1)8-12-21-13-10-19-18(21)15-4-6-16(7-5-15)22-11-2-9-20-22/h1-7,9-11,13-14H,8,12H2
InChIKeyDSNLEFOKDHSZQI-UHFFFAOYSA-N
XLogP3.57
TPSA48.78 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole?
The IUPAC name of 1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole (CID 56879404) is 1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole.
What is the SMILES notation for 1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole?
The canonical SMILES for 1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole is c1coc(CCn2ccnc2-c2ccc(-n3cccn3)cc2)c1.
What is the InChIKey of 1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole?
The InChIKey is DSNLEFOKDHSZQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O/c1-3-17(23-14-1)8-12-21-13-10-19-18(21)15-4-6-16(7-5-15)22-11-2-9-20-22/h1-7,9-11,13-14H,8,12H2.
What are the key properties of 1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole?
1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole has a molecular weight of 304.35 g/mol, XLogP of 3.57, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(furan-2-yl)ethyl]-2-(4-pyrazol-1-ylphenyl)imidazole is sourced from PubChem (CID 56879404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).