2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole

C19H16N2 — CID 10221130

IUPAC2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole
SMILESc1ccc2c(-c3ccc(C4=NCCN4)cc3)cccc2c1
InChIInChI=1S/C19H16N2/c1-2-6-17-14(4-1)5-3-7-18(17)15-8-10-16(11-9-15)19-20-12-13-21-19/h1-11H,12-13H2,(H,20,21)
InChIKeyNMSFRHWJYJDGAP-UHFFFAOYSA-N
MW272.35 g/mol
LogP3.86
Rot. Bonds2

About 2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole

2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole (PubChem CID 10221130) has the molecular formula C19H16N2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole
PubChem CID10221130
Molecular FormulaC19H16N2
Molecular Weight272.35 g/mol
Exact Mass272.13
IUPAC Name2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole
SMILESc1ccc2c(-c3ccc(C4=NCCN4)cc3)cccc2c1
InChIInChI=1S/C19H16N2/c1-2-6-17-14(4-1)5-3-7-18(17)15-8-10-16(11-9-15)19-20-12-13-21-19/h1-11H,12-13H2,(H,20,21)
InChIKeyNMSFRHWJYJDGAP-UHFFFAOYSA-N
XLogP3.86
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole (CID 10221130) is 2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole is c1ccc2c(-c3ccc(C4=NCCN4)cc3)cccc2c1.
What is the InChIKey of 2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole?
The InChIKey is NMSFRHWJYJDGAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2/c1-2-6-17-14(4-1)5-3-7-18(17)15-8-10-16(11-9-15)19-20-12-13-21-19/h1-11H,12-13H2,(H,20,21).
What are the key properties of 2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole?
2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole has a molecular weight of 272.35 g/mol, XLogP of 3.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-naphthalen-1-ylphenyl)-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 10221130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).