7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline

C18H17N3 — CID 936999

IUPAC7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline
SMILESCc1cccc2c3nc4ccccc4nc3n(C(C)C)c12
InChIInChI=1S/C18H17N3/c1-11(2)21-17-12(3)7-6-8-13(17)16-18(21)20-15-10-5-4-9-14(15)19-16/h4-11H,1-3H3
InChIKeyBLYDLZITDXBZEG-UHFFFAOYSA-N
MW275.35 g/mol
LogP4.63
Rot. Bonds1

About 7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline

7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline (PubChem CID 936999) has the molecular formula C18H17N3 and a molecular weight of 275.35 g/mol. Its IUPAC name is 7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline.

Molecular Properties

Compound Name7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline
PubChem CID936999
Molecular FormulaC18H17N3
Molecular Weight275.35 g/mol
Exact Mass275.14
IUPAC Name7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline
SMILESCc1cccc2c3nc4ccccc4nc3n(C(C)C)c12
InChIInChI=1S/C18H17N3/c1-11(2)21-17-12(3)7-6-8-13(17)16-18(21)20-15-10-5-4-9-14(15)19-16/h4-11H,1-3H3
InChIKeyBLYDLZITDXBZEG-UHFFFAOYSA-N
XLogP4.63
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline?
The IUPAC name of 7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline (CID 936999) is 7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline.
What is the SMILES notation for 7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline?
The canonical SMILES for 7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline is Cc1cccc2c3nc4ccccc4nc3n(C(C)C)c12.
What is the InChIKey of 7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline?
The InChIKey is BLYDLZITDXBZEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3/c1-11(2)21-17-12(3)7-6-8-13(17)16-18(21)20-15-10-5-4-9-14(15)19-16/h4-11H,1-3H3.
What are the key properties of 7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline?
7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline has a molecular weight of 275.35 g/mol, XLogP of 4.63, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-6-propan-2-ylindolo[3,2-b]quinoxaline is sourced from PubChem (CID 936999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).