2-(1-tritylimidazol-4-yl)ethanamine

C24H23N3 — CID 618340

IUPAC2-(1-tritylimidazol-4-yl)ethanamine
SMILESNCCc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1
InChIInChI=1S/C24H23N3/c25-17-16-23-18-27(19-26-23)24(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-15,18-19H,16-17,25H2
InChIKeyWZPAUNPMGPHBHT-UHFFFAOYSA-N
MW353.47 g/mol
LogP4.22
Rot. Bonds6

About 2-(1-tritylimidazol-4-yl)ethanamine

2-(1-tritylimidazol-4-yl)ethanamine (PubChem CID 618340) has the molecular formula C24H23N3 and a molecular weight of 353.47 g/mol. Its IUPAC name is 2-(1-tritylimidazol-4-yl)ethanamine.

Molecular Properties

Compound Name2-(1-tritylimidazol-4-yl)ethanamine
PubChem CID618340
Molecular FormulaC24H23N3
Molecular Weight353.47 g/mol
Exact Mass353.19
IUPAC Name2-(1-tritylimidazol-4-yl)ethanamine
SMILESNCCc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1
InChIInChI=1S/C24H23N3/c25-17-16-23-18-27(19-26-23)24(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-15,18-19H,16-17,25H2
InChIKeyWZPAUNPMGPHBHT-UHFFFAOYSA-N
XLogP4.22
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(1-tritylimidazol-4-yl)ethanamine?
The IUPAC name of 2-(1-tritylimidazol-4-yl)ethanamine (CID 618340) is 2-(1-tritylimidazol-4-yl)ethanamine.
What is the SMILES notation for 2-(1-tritylimidazol-4-yl)ethanamine?
The canonical SMILES for 2-(1-tritylimidazol-4-yl)ethanamine is NCCc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1.
What is the InChIKey of 2-(1-tritylimidazol-4-yl)ethanamine?
The InChIKey is WZPAUNPMGPHBHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3/c25-17-16-23-18-27(19-26-23)24(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-15,18-19H,16-17,25H2.
What are the key properties of 2-(1-tritylimidazol-4-yl)ethanamine?
2-(1-tritylimidazol-4-yl)ethanamine has a molecular weight of 353.47 g/mol, XLogP of 4.22, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-tritylimidazol-4-yl)ethanamine is sourced from PubChem (CID 618340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).