2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole

C13H12N4O — CID 19696853

IUPAC2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole
SMILESCOc1cccc(-c2cnc(-c3ncc[nH]3)[nH]2)c1
InChIInChI=1S/C13H12N4O/c1-18-10-4-2-3-9(7-10)11-8-16-13(17-11)12-14-5-6-15-12/h2-8H,1H3,(H,14,15)(H,16,17)
InChIKeyQJGSOJXFOLRSNH-UHFFFAOYSA-N
MW240.27 g/mol
LogP2.48
Rot. Bonds3

About 2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole

2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole (PubChem CID 19696853) has the molecular formula C13H12N4O and a molecular weight of 240.27 g/mol. Its IUPAC name is 2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole.

Molecular Properties

Compound Name2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole
PubChem CID19696853
Molecular FormulaC13H12N4O
Molecular Weight240.27 g/mol
Exact Mass240.10
IUPAC Name2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole
SMILESCOc1cccc(-c2cnc(-c3ncc[nH]3)[nH]2)c1
InChIInChI=1S/C13H12N4O/c1-18-10-4-2-3-9(7-10)11-8-16-13(17-11)12-14-5-6-15-12/h2-8H,1H3,(H,14,15)(H,16,17)
InChIKeyQJGSOJXFOLRSNH-UHFFFAOYSA-N
XLogP2.48
TPSA66.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-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

5-(3-methoxyphenyl)-2-propan-2-yl-1H-imidazole
CID 166267490
2-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]ethanethiol
CID 116879358
ethane;2-(1H-imidazol-2-yl)-4-methylpyrimidine;2-(3-methoxyphenyl)-4-methylpyrimidine
CID 142171320
2-(3,5-dimethoxyphenyl)-1H-imidazole;dihydrochloride
CID 139785129
2-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]-2-methylpropan-1-amine
CID 116876810
4-(3-methoxyphenyl)-1,3-dihydroimidazole-2-thione
CID 25124592
2-amino-2-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]acetic acid
CID 116881507
6-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]hexan-1-amine
CID 43651783
ethyl 5-(3-methoxyphenyl)-1H-imidazole-2-carboxylate
CID 116883542
4-[[5-(3-methoxyphenyl)-1H-imidazol-2-yl]methyl]piperidine
CID 61030336
2-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]pentan-2-amine
CID 60846812
2-[4-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]phenyl]-1-(1,3-thiazol-4-yl)ethanone
CID 157315843

Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole?
The IUPAC name of 2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole (CID 19696853) is 2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole.
What is the SMILES notation for 2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole?
The canonical SMILES for 2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole is COc1cccc(-c2cnc(-c3ncc[nH]3)[nH]2)c1.
What is the InChIKey of 2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole?
The InChIKey is QJGSOJXFOLRSNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O/c1-18-10-4-2-3-9(7-10)11-8-16-13(17-11)12-14-5-6-15-12/h2-8H,1H3,(H,14,15)(H,16,17).
What are the key properties of 2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole?
2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole has a molecular weight of 240.27 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-imidazol-2-yl)-5-(3-methoxyphenyl)-1H-imidazole is sourced from PubChem (CID 19696853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).