4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole

C17H18N2O — CID 175247388

IUPAC4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole
SMILESC1=NC(c2ccccc2)C(COCc2ccccc2)N1
InChIInChI=1S/C17H18N2O/c1-3-7-14(8-4-1)11-20-12-16-17(19-13-18-16)15-9-5-2-6-10-15/h1-10,13,16-17H,11-12H2,(H,18,19)
InChIKeyABBMEHPOGXRUTJ-UHFFFAOYSA-N
MW266.34 g/mol
LogP2.94
Rot. Bonds5

About 4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole

4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole (PubChem CID 175247388) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is 4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole
PubChem CID175247388
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole
SMILESC1=NC(c2ccccc2)C(COCc2ccccc2)N1
InChIInChI=1S/C17H18N2O/c1-3-7-14(8-4-1)11-20-12-16-17(19-13-18-16)15-9-5-2-6-10-15/h1-10,13,16-17H,11-12H2,(H,18,19)
InChIKeyABBMEHPOGXRUTJ-UHFFFAOYSA-N
XLogP2.94
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole?
The IUPAC name of 4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole (CID 175247388) is 4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole?
The canonical SMILES for 4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole is C1=NC(c2ccccc2)C(COCc2ccccc2)N1.
What is the InChIKey of 4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole?
The InChIKey is ABBMEHPOGXRUTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-3-7-14(8-4-1)11-20-12-16-17(19-13-18-16)15-9-5-2-6-10-15/h1-10,13,16-17H,11-12H2,(H,18,19).
What are the key properties of 4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole?
4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole has a molecular weight of 266.34 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-5-(phenylmethoxymethyl)-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 175247388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).