2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole

C10H10Cl2N2O — CID 28918757

IUPAC2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole
SMILESClc1cc(Cl)cc(OCC2=NCCN2)c1
InChIInChI=1S/C10H10Cl2N2O/c11-7-3-8(12)5-9(4-7)15-6-10-13-1-2-14-10/h3-5H,1-2,6H2,(H,13,14)
InChIKeyABBDHJHZDXTBLA-UHFFFAOYSA-N
MW245.11 g/mol
LogP2.37
Rot. Bonds3

About 2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole

2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole (PubChem CID 28918757) has the molecular formula C10H10Cl2N2O and a molecular weight of 245.11 g/mol. Its IUPAC name is 2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole
PubChem CID28918757
Molecular FormulaC10H10Cl2N2O
Molecular Weight245.11 g/mol
Exact Mass244.02
IUPAC Name2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole
SMILESClc1cc(Cl)cc(OCC2=NCCN2)c1
InChIInChI=1S/C10H10Cl2N2O/c11-7-3-8(12)5-9(4-7)15-6-10-13-1-2-14-10/h3-5H,1-2,6H2,(H,13,14)
InChIKeyABBDHJHZDXTBLA-UHFFFAOYSA-N
XLogP2.37
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.11
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-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-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole (CID 28918757) is 2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole is Clc1cc(Cl)cc(OCC2=NCCN2)c1.
What is the InChIKey of 2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole?
The InChIKey is ABBDHJHZDXTBLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Cl2N2O/c11-7-3-8(12)5-9(4-7)15-6-10-13-1-2-14-10/h3-5H,1-2,6H2,(H,13,14).
What are the key properties of 2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole?
2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole has a molecular weight of 245.11 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,5-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 28918757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).