2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole

C17H16Cl2N2O2 — CID 82252922

IUPAC2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole
SMILESCOc1cccc(C2=NCCN2)c1OCc1c(Cl)cccc1Cl
InChIInChI=1S/C17H16Cl2N2O2/c1-22-15-7-2-4-11(17-20-8-9-21-17)16(15)23-10-12-13(18)5-3-6-14(12)19/h2-7H,8-10H2,1H3,(H,20,21)
InChIKeyWELUXSHTJLEXSC-UHFFFAOYSA-N
MW351.23 g/mol
LogP3.93
Rot. Bonds5

About 2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole

2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole (PubChem CID 82252922) has the molecular formula C17H16Cl2N2O2 and a molecular weight of 351.23 g/mol. Its IUPAC name is 2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole
PubChem CID82252922
Molecular FormulaC17H16Cl2N2O2
Molecular Weight351.23 g/mol
Exact Mass350.06
IUPAC Name2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole
SMILESCOc1cccc(C2=NCCN2)c1OCc1c(Cl)cccc1Cl
InChIInChI=1S/C17H16Cl2N2O2/c1-22-15-7-2-4-11(17-20-8-9-21-17)16(15)23-10-12-13(18)5-3-6-14(12)19/h2-7H,8-10H2,1H3,(H,20,21)
InChIKeyWELUXSHTJLEXSC-UHFFFAOYSA-N
XLogP3.93
TPSA42.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.23
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole (CID 82252922) is 2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole is COc1cccc(C2=NCCN2)c1OCc1c(Cl)cccc1Cl.
What is the InChIKey of 2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole?
The InChIKey is WELUXSHTJLEXSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16Cl2N2O2/c1-22-15-7-2-4-11(17-20-8-9-21-17)16(15)23-10-12-13(18)5-3-6-14(12)19/h2-7H,8-10H2,1H3,(H,20,21).
What are the key properties of 2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole?
2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole has a molecular weight of 351.23 g/mol, XLogP of 3.93, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 82252922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).