2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole

C20H16N2 — CID 45137155

IUPAC2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole
SMILESc1ccc(-c2cnc(Cc3cccc4ccccc34)[nH]2)cc1
InChIInChI=1S/C20H16N2/c1-2-8-16(9-3-1)19-14-21-20(22-19)13-17-11-6-10-15-7-4-5-12-18(15)17/h1-12,14H,13H2,(H,21,22)
InChIKeyJXPHGWCDBPVUNN-UHFFFAOYSA-N
MW284.36 g/mol
LogP4.82
Rot. Bonds3

About 2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole

2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole (PubChem CID 45137155) has the molecular formula C20H16N2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole.

Molecular Properties

Compound Name2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole
PubChem CID45137155
Molecular FormulaC20H16N2
Molecular Weight284.36 g/mol
Exact Mass284.13
IUPAC Name2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole
SMILESc1ccc(-c2cnc(Cc3cccc4ccccc34)[nH]2)cc1
InChIInChI=1S/C20H16N2/c1-2-8-16(9-3-1)19-14-21-20(22-19)13-17-11-6-10-15-7-4-5-12-18(15)17/h1-12,14H,13H2,(H,21,22)
InChIKeyJXPHGWCDBPVUNN-UHFFFAOYSA-N
XLogP4.82
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(2,3-dichlorophenyl)methyl]-5-phenyl-1H-imidazole
CID 141255839
2-(naphthalen-1-ylmethylsulfanyl)-5-phenyl-1H-imidazole
CID 588118
2-(naphthalen-1-ylmethyl)-6-oxo-1H-pyrimidine-5-carboxylic acid
CID 99976497
[5-(4-phenylphenyl)-1H-imidazol-2-yl]methanethiol
CID 116879175
N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride
CID 72716194
2-(chloromethyl)-5-phenyl-1H-imidazole;hydrochloride
CID 139644021
2-[(2-chlorophenyl)methyl]-5-(4-propan-2-ylphenyl)-1H-imidazole
CID 46198734
2-phenanthren-1-yl-5-phenyl-1H-imidazole
CID 174638740
2-(5-phenyl-1H-imidazol-2-yl)ethanamine;dihydrochloride
CID 13170817
1-(5-phenyl-1H-imidazol-2-yl)propan-2-amine
CID 60840875
azane;5-phenyl-2-(3-phenylpropyl)-1H-imidazole
CID 174441840
CID 66760372
CID 66760372

Frequently Asked Questions

What is the IUPAC name of 2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole?
The IUPAC name of 2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole (CID 45137155) is 2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole.
What is the SMILES notation for 2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole?
The canonical SMILES for 2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole is c1ccc(-c2cnc(Cc3cccc4ccccc34)[nH]2)cc1.
What is the InChIKey of 2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole?
The InChIKey is JXPHGWCDBPVUNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2/c1-2-8-16(9-3-1)19-14-21-20(22-19)13-17-11-6-10-15-7-4-5-12-18(15)17/h1-12,14H,13H2,(H,21,22).
What are the key properties of 2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole?
2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole has a molecular weight of 284.36 g/mol, XLogP of 4.82, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(naphthalen-1-ylmethyl)-5-phenyl-1H-imidazole is sourced from PubChem (CID 45137155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).