1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile

C24H20N2O3 — CID 134976633

IUPAC1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile
SMILESCOc1ccc(-c2c(OC)c3c(C#N)cccn3c2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H20N2O3/c1-27-19-10-6-16(7-11-19)21-22(17-8-12-20(28-2)13-9-17)26-14-4-5-18(15-25)23(26)24(21)29-3/h4-14H,1-3H3
InChIKeyJFCZBYRPPIXLDL-UHFFFAOYSA-N
MW384.44 g/mol
LogP5.17
Rot. Bonds5

About 1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile

1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile (PubChem CID 134976633) has the molecular formula C24H20N2O3 and a molecular weight of 384.44 g/mol. Its IUPAC name is 1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile.

Molecular Properties

Compound Name1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile
PubChem CID134976633
Molecular FormulaC24H20N2O3
Molecular Weight384.44 g/mol
Exact Mass384.15
IUPAC Name1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile
SMILESCOc1ccc(-c2c(OC)c3c(C#N)cccn3c2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H20N2O3/c1-27-19-10-6-16(7-11-19)21-22(17-8-12-20(28-2)13-9-17)26-14-4-5-18(15-25)23(26)24(21)29-3/h4-14H,1-3H3
InChIKeyJFCZBYRPPIXLDL-UHFFFAOYSA-N
XLogP5.17
TPSA55.89 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.44
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile 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-(4-methoxyphenyl)-3-methylpyrrolo[2,1-a]isoquinoline-1-carbonitrile
CID 178031478
3-(4-methoxyphenyl)-2,8-dimethylimidazo[1,2-a]pyridine
CID 115404302
2-amino-1-benzyl-5-(4-methoxyphenyl)-4-phenylpyrrole-3-carbonitrile
CID 59536507
3-chloro-2-(4-methoxyphenyl)-1-methylindole-5,6-dicarbonitrile
CID 118727528
8-chloro-3-(4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine
CID 103095082
5-(4-methoxyphenyl)-4-(4-methylphenyl)pyrrolo[1,2-a]quinoline
CID 53387757
2-amino-1-hydroxy-3-(4-methoxyphenyl)indole-5,6-dicarbonitrile
CID 45490315
2-methoxy-5-(4-methoxyphenyl)benzonitrile
CID 59113876
2-[2-[2-[2-(4-methoxyphenyl)ethynyl]phenyl]ethynyl]benzonitrile
CID 71419198
1-ethyl-2-(4-methoxyphenyl)indole-3-carbonitrile
CID 22689252
2-(4-methoxyphenyl)-1-oxidoindole-5,6-dicarbonitrile
CID 51802202
4-(4-methoxyphenyl)-2-phenyl-5-(trifluoromethyl)pyrazole-3-carbonitrile
CID 172842617

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile?
The IUPAC name of 1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile (CID 134976633) is 1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile.
What is the SMILES notation for 1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile?
The canonical SMILES for 1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile is COc1ccc(-c2c(OC)c3c(C#N)cccn3c2-c2ccc(OC)cc2)cc1.
What is the InChIKey of 1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile?
The InChIKey is JFCZBYRPPIXLDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O3/c1-27-19-10-6-16(7-11-19)21-22(17-8-12-20(28-2)13-9-17)26-14-4-5-18(15-25)23(26)24(21)29-3/h4-14H,1-3H3.
What are the key properties of 1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile?
1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile has a molecular weight of 384.44 g/mol, XLogP of 5.17, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2,3-bis(4-methoxyphenyl)indolizine-8-carbonitrile is sourced from PubChem (CID 134976633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).