1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole

C22H20N2O3 — CID 11639084

IUPAC1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole
SMILESCOc1cc(-c2nccn2-c2ccc3ccccc3c2)cc(OC)c1OC
InChIInChI=1S/C22H20N2O3/c1-25-19-13-17(14-20(26-2)21(19)27-3)22-23-10-11-24(22)18-9-8-15-6-4-5-7-16(15)12-18/h4-14H,1-3H3
InChIKeyQHLHXSSILZPKFF-UHFFFAOYSA-N
MW360.41 g/mol
LogP4.72
Rot. Bonds5

About 1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole

1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole (PubChem CID 11639084) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is 1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole.

Molecular Properties

Compound Name1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole
PubChem CID11639084
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC Name1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole
SMILESCOc1cc(-c2nccn2-c2ccc3ccccc3c2)cc(OC)c1OC
InChIInChI=1S/C22H20N2O3/c1-25-19-13-17(14-20(26-2)21(19)27-3)22-23-10-11-24(22)18-9-8-15-6-4-5-7-16(15)12-18/h4-14H,1-3H3
InChIKeyQHLHXSSILZPKFF-UHFFFAOYSA-N
XLogP4.72
TPSA45.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(6-Methoxynaphthalen-2-yl)-1H-imidazole
CID 11514098
1-(1,3-Benzodioxol-5-Ylmethyl)-5,6,7,8-Tetrahydro-1h-Naphtho[2,3-D]imidazole
CID 73442274
2-(1-methylindol-4-yl)-7-(3,4,5-trimethoxyphenyl)-1~{H}-benzimidazole
CID 156619925
5-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-1H-imidazole
CID 11290749
2-(naphthalen-2-yl)-1-(3,5-trimethoxyphenyl)-1H-imidazole
CID 11559546
1-(4-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole
CID 11688687
5-phenyl-2-[(3,4,5-trimethoxyphenyl)methyl]-1H-imidazole
CID 71717474
Tubulin polymerization-IN-47
CID 165177911
6-(3,5-Dimethoxyphenyl)-2-(4-methoxyphenyl)imidazo[1,2-a]pyridine
CID 155514980
1-Methyl-2-(3,4,5-trimethoxyphenyl)imidazo[4,5-c]pyridine
CID 655187
N,N-dimethyl-4-(1-(3,4,5-trimethoxyphenyl)-1H-imidazol-5-yl)aniline
CID 10893577
N,N-dimethyl-4-(1-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-yl)aniline
CID 10915201

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole?
The IUPAC name of 1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole (CID 11639084) is 1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole.
What is the SMILES notation for 1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole?
The canonical SMILES for 1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole is COc1cc(-c2nccn2-c2ccc3ccccc3c2)cc(OC)c1OC.
What is the InChIKey of 1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole?
The InChIKey is QHLHXSSILZPKFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O3/c1-25-19-13-17(14-20(26-2)21(19)27-3)22-23-10-11-24(22)18-9-8-15-6-4-5-7-16(15)12-18/h4-14H,1-3H3.
What are the key properties of 1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole?
1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole has a molecular weight of 360.41 g/mol, XLogP of 4.72, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-2-(3,4,5-trimethoxyphenyl)imidazole is sourced from PubChem (CID 11639084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).