2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole

C13H14N2O — CID 4302964

IUPAC2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole
SMILESCCC1(c2ncc[nH]2)Cc2ccccc2O1
InChIInChI=1S/C13H14N2O/c1-2-13(12-14-7-8-15-12)9-10-5-3-4-6-11(10)16-13/h3-8H,2,9H2,1H3,(H,14,15)
InChIKeyJCWVNNMJXQJVNC-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.65
Rot. Bonds2

About 2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole

2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole (PubChem CID 4302964) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole.

Molecular Properties

Compound Name2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole
PubChem CID4302964
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole
SMILESCCC1(c2ncc[nH]2)Cc2ccccc2O1
InChIInChI=1S/C13H14N2O/c1-2-13(12-14-7-8-15-12)9-10-5-3-4-6-11(10)16-13/h3-8H,2,9H2,1H3,(H,14,15)
InChIKeyJCWVNNMJXQJVNC-UHFFFAOYSA-N
XLogP2.65
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole with MolForge

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

Launch Full Analysis

Related Compounds

Lepidine C
CID 100927765
2-(4-Butoxy-phenyl)-1H-imidazole
CID 11195292
(R)-2-(2-Ethyl-2,3-dihydrobenzofuran-2-yl)-1H-imidazole
CID 6604823
2-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1H-imidazole
CID 44362145
2-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-1H-imidazole
CID 44449277
2-(2-ethylphenoxy)-N-[2-(1H-imidazol-4-yl)ethyl]ethanamine
CID 50981993
N-(1H-imidazol-2-ylmethyl)-N-methyl-1-(2,3,4,5-tetrahydro-1-benzoxepin-4-yl)methanamine
CID 72883296
2-(2-ethylphenoxy)-N-(1H-imidazol-2-ylmethyl)-N-methylethanamine
CID 50968779
2-(2-Methoxyphenyl)-1h-imidazole
CID 12622721
2-(4-Methoxybenzyl)-1H-imidazole
CID 13621740
5-[2-(2-methoxyphenyl)ethyl]-1H-imidazole
CID 20190498
2-Imidazolylthiochromone
CID 21465608

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole?
The IUPAC name of 2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole (CID 4302964) is 2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole.
What is the SMILES notation for 2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole?
The canonical SMILES for 2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole is CCC1(c2ncc[nH]2)Cc2ccccc2O1.
What is the InChIKey of 2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole?
The InChIKey is JCWVNNMJXQJVNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-2-13(12-14-7-8-15-12)9-10-5-3-4-6-11(10)16-13/h3-8H,2,9H2,1H3,(H,14,15).
What are the key properties of 2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole?
2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole has a molecular weight of 214.27 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole is sourced from PubChem (CID 4302964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).