2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole

C17H18N2 — CID 11311265

IUPAC2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole
SMILESc1ccc(CCc2ccccc2C2=NCCN2)cc1
InChIInChI=1S/C17H18N2/c1-2-6-14(7-3-1)10-11-15-8-4-5-9-16(15)17-18-12-13-19-17/h1-9H,10-13H2,(H,18,19)
InChIKeyGHCKOGDITJNILQ-UHFFFAOYSA-N
MW250.35 g/mol
LogP2.82
Rot. Bonds4

About 2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole

2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole (PubChem CID 11311265) has the molecular formula C17H18N2 and a molecular weight of 250.35 g/mol. Its IUPAC name is 2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole
PubChem CID11311265
Molecular FormulaC17H18N2
Molecular Weight250.35 g/mol
Exact Mass250.15
IUPAC Name2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole
SMILESc1ccc(CCc2ccccc2C2=NCCN2)cc1
InChIInChI=1S/C17H18N2/c1-2-6-14(7-3-1)10-11-15-8-4-5-9-16(15)17-18-12-13-19-17/h1-9H,10-13H2,(H,18,19)
InChIKeyGHCKOGDITJNILQ-UHFFFAOYSA-N
XLogP2.82
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole (CID 11311265) is 2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole is c1ccc(CCc2ccccc2C2=NCCN2)cc1.
What is the InChIKey of 2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole?
The InChIKey is GHCKOGDITJNILQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2/c1-2-6-14(7-3-1)10-11-15-8-4-5-9-16(15)17-18-12-13-19-17/h1-9H,10-13H2,(H,18,19).
What are the key properties of 2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole?
2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole has a molecular weight of 250.35 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 11311265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).