5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol

C21H19N3O2 — CID 136895019

IUPAC5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol
SMILESCOc1ccccc1CCc1nc(O)c(/C=C2\C=Nc3ccccc32)[nH]1
InChIInChI=1S/C21H19N3O2/c1-26-19-9-5-2-6-14(19)10-11-20-23-18(21(25)24-20)12-15-13-22-17-8-4-3-7-16(15)17/h2-9,12-13,25H,10-11H2,1H3,(H,23,24)/b15-12+
InChIKeyLASIMRANECDNJA-NTCAYCPXSA-N
MW345.40 g/mol
LogP4.17
Rot. Bonds5

About 5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol

5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol (PubChem CID 136895019) has the molecular formula C21H19N3O2 and a molecular weight of 345.40 g/mol. Its IUPAC name is 5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol.

Molecular Properties

Compound Name5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol
PubChem CID136895019
Molecular FormulaC21H19N3O2
Molecular Weight345.40 g/mol
Exact Mass345.15
IUPAC Name5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol
SMILESCOc1ccccc1CCc1nc(O)c(/C=C2\C=Nc3ccccc32)[nH]1
InChIInChI=1S/C21H19N3O2/c1-26-19-9-5-2-6-14(19)10-11-20-23-18(21(25)24-20)12-15-13-22-17-8-4-3-7-16(15)17/h2-9,12-13,25H,10-11H2,1H3,(H,23,24)/b15-12+
InChIKeyLASIMRANECDNJA-NTCAYCPXSA-N
XLogP4.17
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 54.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-hydroxy-5-[(E)-indol-3-ylidenemethyl]-1-(2-methoxyphenyl)pyrimidine-2,4-dione
CID 135630159
2-[2-(2-methoxyphenyl)ethyl]phenol
CID 10775715
4-[(Z)-indol-3-ylidenemethyl]-2-(2-methylpropyl)-1,3-oxazol-5-ol
CID 136843089
2-[2-(2-methoxyphenyl)ethyl]-5-methyl-1,3-oxazole-4-carboxylic acid
CID 82302112
N-(1H-benzimidazol-2-ylmethyl)-3-(2-methoxyphenyl)propanamide
CID 18105005
2-[[4-hydroxy-5-[(E)-indol-3-ylidenemethyl]-1,3-thiazol-2-yl]-methylamino]benzoic acid
CID 137263314
4-(indol-3-ylidenemethyl)-5-(4-methoxyphenyl)-2-methyl-1H-pyrazol-3-one
CID 27877235
1-[3-(1H-benzimidazol-2-yl)propyl]-3-[(2-methoxyphenyl)methyl]urea
CID 24612830
ethane;1-methoxy-2-[3-(2-methoxyphenyl)propyl]benzene
CID 91290457
2-(propylamino)-5-[(Z)-pyrrolo[2,3-b]pyridin-3-ylidenemethyl]-1H-imidazol-4-ol
CID 135712522
2-[(2-methoxyphenyl)methylsulfanyl]-1H-benzimidazole
CID 752044
2-(2-ethyl-3H-benzimidazol-5-yl)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 110772738

Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol?
The IUPAC name of 5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol (CID 136895019) is 5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol.
What is the SMILES notation for 5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol?
The canonical SMILES for 5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol is COc1ccccc1CCc1nc(O)c(/C=C2\C=Nc3ccccc32)[nH]1.
What is the InChIKey of 5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol?
The InChIKey is LASIMRANECDNJA-NTCAYCPXSA-N. The full InChI is InChI=1S/C21H19N3O2/c1-26-19-9-5-2-6-14(19)10-11-20-23-18(21(25)24-20)12-15-13-22-17-8-4-3-7-16(15)17/h2-9,12-13,25H,10-11H2,1H3,(H,23,24)/b15-12+.
What are the key properties of 5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol?
5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol has a molecular weight of 345.40 g/mol, XLogP of 4.17, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-indol-3-ylidenemethyl]-2-[2-(2-methoxyphenyl)ethyl]-1H-imidazol-4-ol is sourced from PubChem (CID 136895019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).