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

C11H14N2O — CID 14639163

IUPAC2-[(3-methoxyphenyl)methyl]-4,5-dihydro-1H-imidazole
SMILESCOc1cccc(CC2=NCCN2)c1
InChIInChI=1S/C11H14N2O/c1-14-10-4-2-3-9(7-10)8-11-12-5-6-13-11/h2-4,7H,5-6,8H2,1H3,(H,12,13)
InChIKeyCHANOIREVPUIDA-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.24
Rot. Bonds3

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

2-[(3-methoxyphenyl)methyl]-4,5-dihydro-1H-imidazole (PubChem CID 14639163) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-[(3-methoxyphenyl)methyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[(3-methoxyphenyl)methyl]-4,5-dihydro-1H-imidazole
PubChem CID14639163
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name2-[(3-methoxyphenyl)methyl]-4,5-dihydro-1H-imidazole
SMILESCOc1cccc(CC2=NCCN2)c1
InChIInChI=1S/C11H14N2O/c1-14-10-4-2-3-9(7-10)8-11-12-5-6-13-11/h2-4,7H,5-6,8H2,1H3,(H,12,13)
InChIKeyCHANOIREVPUIDA-UHFFFAOYSA-N
XLogP1.24
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(3-methoxyphenyl)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-methoxyphenyl)methyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[(3-methoxyphenyl)methyl]-4,5-dihydro-1H-imidazole (CID 14639163) is 2-[(3-methoxyphenyl)methyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[(3-methoxyphenyl)methyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[(3-methoxyphenyl)methyl]-4,5-dihydro-1H-imidazole is COc1cccc(CC2=NCCN2)c1.
What is the InChIKey of 2-[(3-methoxyphenyl)methyl]-4,5-dihydro-1H-imidazole?
The InChIKey is CHANOIREVPUIDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-14-10-4-2-3-9(7-10)8-11-12-5-6-13-11/h2-4,7H,5-6,8H2,1H3,(H,12,13).
What are the key properties of 2-[(3-methoxyphenyl)methyl]-4,5-dihydro-1H-imidazole?
2-[(3-methoxyphenyl)methyl]-4,5-dihydro-1H-imidazole has a molecular weight of 190.25 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxyphenyl)methyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 14639163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).