7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline

C25H23N3O — CID 3700504

IUPAC7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline
SMILESCCCOc1ccccc1Cn1c2nc3ccccc3nc2c2cccc(C)c21
InChIInChI=1S/C25H23N3O/c1-3-15-29-22-14-7-4-10-18(22)16-28-24-17(2)9-8-11-19(24)23-25(28)27-21-13-6-5-12-20(21)26-23/h4-14H,3,15-16H2,1-2H3
InChIKeyNMTQMYPHBBGCNI-UHFFFAOYSA-N
MW381.48 g/mol
LogP5.88
Rot. Bonds5

About 7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline

7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline (PubChem CID 3700504) has the molecular formula C25H23N3O and a molecular weight of 381.48 g/mol. Its IUPAC name is 7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline.

Molecular Properties

Compound Name7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline
PubChem CID3700504
Molecular FormulaC25H23N3O
Molecular Weight381.48 g/mol
Exact Mass381.18
IUPAC Name7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline
SMILESCCCOc1ccccc1Cn1c2nc3ccccc3nc2c2cccc(C)c21
InChIInChI=1S/C25H23N3O/c1-3-15-29-22-14-7-4-10-18(22)16-28-24-17(2)9-8-11-19(24)23-25(28)27-21-13-6-5-12-20(21)26-23/h4-14H,3,15-16H2,1-2H3
InChIKeyNMTQMYPHBBGCNI-UHFFFAOYSA-N
XLogP5.88
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.48
LogP ≤ 55.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline?
The IUPAC name of 7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline (CID 3700504) is 7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline.
What is the SMILES notation for 7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline?
The canonical SMILES for 7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline is CCCOc1ccccc1Cn1c2nc3ccccc3nc2c2cccc(C)c21.
What is the InChIKey of 7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline?
The InChIKey is NMTQMYPHBBGCNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3O/c1-3-15-29-22-14-7-4-10-18(22)16-28-24-17(2)9-8-11-19(24)23-25(28)27-21-13-6-5-12-20(21)26-23/h4-14H,3,15-16H2,1-2H3.
What are the key properties of 7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline?
7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline has a molecular weight of 381.48 g/mol, XLogP of 5.88, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-6-[(2-propoxyphenyl)methyl]indolo[3,2-b]quinoxaline is sourced from PubChem (CID 3700504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).