6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol

C20H22N4O — CID 165416973

IUPAC6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol
SMILESCc1cc2nc3c4cccc(O)c4n(CCN(C)C)c3nc2cc1C
InChIInChI=1S/C20H22N4O/c1-12-10-15-16(11-13(12)2)22-20-18(21-15)14-6-5-7-17(25)19(14)24(20)9-8-23(3)4/h5-7,10-11,25H,8-9H2,1-4H3
InChIKeyIWCAGPJBVMLTGC-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.62
Rot. Bonds3

About 6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol

6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol (PubChem CID 165416973) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is 6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol.

Molecular Properties

Compound Name6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol
PubChem CID165416973
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC Name6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol
SMILESCc1cc2nc3c4cccc(O)c4n(CCN(C)C)c3nc2cc1C
InChIInChI=1S/C20H22N4O/c1-12-10-15-16(11-13(12)2)22-20-18(21-15)14-6-5-7-17(25)19(14)24(20)9-8-23(3)4/h5-7,10-11,25H,8-9H2,1-4H3
InChIKeyIWCAGPJBVMLTGC-UHFFFAOYSA-N
XLogP3.62
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol?
The IUPAC name of 6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol (CID 165416973) is 6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol.
What is the SMILES notation for 6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol?
The canonical SMILES for 6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol is Cc1cc2nc3c4cccc(O)c4n(CCN(C)C)c3nc2cc1C.
What is the InChIKey of 6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol?
The InChIKey is IWCAGPJBVMLTGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-12-10-15-16(11-13(12)2)22-20-18(21-15)14-6-5-7-17(25)19(14)24(20)9-8-23(3)4/h5-7,10-11,25H,8-9H2,1-4H3.
What are the key properties of 6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol?
6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol has a molecular weight of 334.42 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(dimethylamino)ethyl]-2,3-dimethylindolo[3,2-b]quinoxalin-7-ol is sourced from PubChem (CID 165416973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).