6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde

C25H23NO2 — CID 3533161

IUPAC6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde
SMILESCCc1ccc2cc(-c3ccc(OCc4ccccc4)c(C)c3)c(C=O)n2c1
InChIInChI=1S/C25H23NO2/c1-3-19-9-11-22-14-23(24(16-27)26(22)15-19)21-10-12-25(18(2)13-21)28-17-20-7-5-4-6-8-20/h4-16H,3,17H2,1-2H3
InChIKeyQIXGCGUDEPBUEO-UHFFFAOYSA-N
MW369.46 g/mol
LogP5.87
Rot. Bonds6

About 6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde

6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde (PubChem CID 3533161) has the molecular formula C25H23NO2 and a molecular weight of 369.46 g/mol. Its IUPAC name is 6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde.

Molecular Properties

Compound Name6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde
PubChem CID3533161
Molecular FormulaC25H23NO2
Molecular Weight369.46 g/mol
Exact Mass369.17
IUPAC Name6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde
SMILESCCc1ccc2cc(-c3ccc(OCc4ccccc4)c(C)c3)c(C=O)n2c1
InChIInChI=1S/C25H23NO2/c1-3-19-9-11-22-14-23(24(16-27)26(22)15-19)21-10-12-25(18(2)13-21)28-17-20-7-5-4-6-8-20/h4-16H,3,17H2,1-2H3
InChIKeyQIXGCGUDEPBUEO-UHFFFAOYSA-N
XLogP5.87
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.46
LogP ≤ 55.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde 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

2-(4,5-dimethyl-2-phenylmethoxyphenyl)-6-ethylindolizine-3-carbaldehyde
CID 3819347
2-(5-chloro-4-methyl-2-phenylmethoxyphenyl)-6-ethylindolizine-3-carbaldehyde
CID 3652489
6-ethyl-2-(4-methoxy-3,5-dimethylphenyl)indolizine-3-carbaldehyde
CID 4314891
2-(5-ethyl-2-phenylmethoxyphenyl)indolizine-3-carbaldehyde
CID 3760707
6-methyl-2-(2-phenylmethoxyphenyl)indolizine-3-carbaldehyde
CID 4254020
6-ethyl-2-(4-methoxy-3-propan-2-ylphenyl)indolizine-3-carbaldehyde
CID 3696408
2-(3-tert-butyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde
CID 3817177
6-ethyl-2-pyridin-4-ylindolizine-3-carbaldehyde
CID 3764927
2-(2,4-diethoxynaphthalen-1-yl)-6-ethylindolizine-3-carbaldehyde
CID 3750994
2-(3-chloro-4-phenylmethoxyphenyl)-8-methylindolizine-3-carbaldehyde
CID 3697340
6-ethyl-2-(4-ethylsulfanylphenyl)indolizine-3-carbaldehyde
CID 5104649
6-methyl-2-(5-nitro-2-phenylmethoxyphenyl)indolizine-3-carbaldehyde
CID 3580229

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde?
The IUPAC name of 6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde (CID 3533161) is 6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde.
What is the SMILES notation for 6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde?
The canonical SMILES for 6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde is CCc1ccc2cc(-c3ccc(OCc4ccccc4)c(C)c3)c(C=O)n2c1.
What is the InChIKey of 6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde?
The InChIKey is QIXGCGUDEPBUEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23NO2/c1-3-19-9-11-22-14-23(24(16-27)26(22)15-19)21-10-12-25(18(2)13-21)28-17-20-7-5-4-6-8-20/h4-16H,3,17H2,1-2H3.
What are the key properties of 6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde?
6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde has a molecular weight of 369.46 g/mol, XLogP of 5.87, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-(3-methyl-4-phenylmethoxyphenyl)indolizine-3-carbaldehyde is sourced from PubChem (CID 3533161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).