2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole

C18H16N4O2 — CID 169050106

IUPAC2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole
SMILESCOc1ccc2c(-c3ncc[nH]3)c(OC)ccc2c1-c1ncc[nH]1
InChIInChI=1S/C18H16N4O2/c1-23-13-5-3-12-11(15(13)17-19-7-8-20-17)4-6-14(24-2)16(12)18-21-9-10-22-18/h3-10H,1-2H3,(H,19,20)(H,21,22)
InChIKeyQZPWHOGLWZSYPJ-UHFFFAOYSA-N
MW320.35 g/mol
LogP3.64
Rot. Bonds4

About 2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole

2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole (PubChem CID 169050106) has the molecular formula C18H16N4O2 and a molecular weight of 320.35 g/mol. Its IUPAC name is 2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole.

Molecular Properties

Compound Name2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole
PubChem CID169050106
Molecular FormulaC18H16N4O2
Molecular Weight320.35 g/mol
Exact Mass320.13
IUPAC Name2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole
SMILESCOc1ccc2c(-c3ncc[nH]3)c(OC)ccc2c1-c1ncc[nH]1
InChIInChI=1S/C18H16N4O2/c1-23-13-5-3-12-11(15(13)17-19-7-8-20-17)4-6-14(24-2)16(12)18-21-9-10-22-18/h3-10H,1-2H3,(H,19,20)(H,21,22)
InChIKeyQZPWHOGLWZSYPJ-UHFFFAOYSA-N
XLogP3.64
TPSA75.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-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

Frequently Asked Questions

What is the IUPAC name of 2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole?
The IUPAC name of 2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole (CID 169050106) is 2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole.
What is the SMILES notation for 2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole?
The canonical SMILES for 2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole is COc1ccc2c(-c3ncc[nH]3)c(OC)ccc2c1-c1ncc[nH]1.
What is the InChIKey of 2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole?
The InChIKey is QZPWHOGLWZSYPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O2/c1-23-13-5-3-12-11(15(13)17-19-7-8-20-17)4-6-14(24-2)16(12)18-21-9-10-22-18/h3-10H,1-2H3,(H,19,20)(H,21,22).
What are the key properties of 2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole?
2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole has a molecular weight of 320.35 g/mol, XLogP of 3.64, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(1H-imidazol-2-yl)-2,6-dimethoxynaphthalen-1-yl]-1H-imidazole is sourced from PubChem (CID 169050106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).