6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone

C21H20N4O — CID 6067244

IUPAC6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)c2ccc3[nH]c4nc5ccccc5nc4c3c2)CC1
InChIInChI=1S/C21H20N4O/c1-13-8-10-25(11-9-13)21(26)14-6-7-16-15(12-14)19-20(23-16)24-18-5-3-2-4-17(18)22-19/h2-7,12-13H,8-11H2,1H3,(H,23,24)
InChIKeyQXURWTQQRASUTH-UHFFFAOYSA-N
MW344.42 g/mol
LogP4.14
Rot. Bonds1

About 6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone

6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone (PubChem CID 6067244) has the molecular formula C21H20N4O and a molecular weight of 344.42 g/mol. Its IUPAC name is 6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone
PubChem CID6067244
Molecular FormulaC21H20N4O
Molecular Weight344.42 g/mol
Exact Mass344.16
IUPAC Name6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)c2ccc3[nH]c4nc5ccccc5nc4c3c2)CC1
InChIInChI=1S/C21H20N4O/c1-13-8-10-25(11-9-13)21(26)14-6-7-16-15(12-14)19-20(23-16)24-18-5-3-2-4-17(18)22-19/h2-7,12-13H,8-11H2,1H3,(H,23,24)
InChIKeyQXURWTQQRASUTH-UHFFFAOYSA-N
XLogP4.14
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone with MolForge

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Related Compounds

8-(4-methylpiperidine-1-carbonyl)-11H-indolo[3,2-c]quinoline-6-carboxylic acid
CID 16730107
(2,3-dimethyl-1H-indol-5-yl)-(4-methylazepan-1-yl)methanone
CID 62046658
6H-indolo[3,2-b]quinoxaline-8-carboxylic acid
CID 68570338
(2-cyclopentyl-1,3,4,5-tetrahydropyrido[4,3-b]indol-8-yl)-(4-methylpiperidin-1-yl)methanone;ethane
CID 143296321
(2-cyclohexyl-1,3,4,5-tetrahydropyrido[4,3-b]indol-8-yl)-(4-methylpiperidin-1-yl)methanone
CID 173179128
(3-ethynylphenyl)-(4-methylpiperidin-1-yl)methanone
CID 170459136
N-[3-(4-methylpiperidine-1-carbonyl)phenyl]benzamide
CID 4019473
(4-methylpiperidin-1-yl)-[1-(4-phenylpiperazin-1-yl)isoquinolin-7-yl]methanone
CID 53035343
[4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone
CID 109044208
[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-(6-methyl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)methanone
CID 154836446
(3-aminophenyl)-(4-methylpiperidin-1-yl)methanone
CID 16778020
(4-methylphenyl)-(4-methylpiperidin-1-yl)methanone
CID 723102

Frequently Asked Questions

What is the IUPAC name of 6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of 6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone (CID 6067244) is 6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for 6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for 6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone is CC1CCN(C(=O)c2ccc3[nH]c4nc5ccccc5nc4c3c2)CC1.
What is the InChIKey of 6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone?
The InChIKey is QXURWTQQRASUTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O/c1-13-8-10-25(11-9-13)21(26)14-6-7-16-15(12-14)19-20(23-16)24-18-5-3-2-4-17(18)22-19/h2-7,12-13H,8-11H2,1H3,(H,23,24).
What are the key properties of 6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone?
6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone has a molecular weight of 344.42 g/mol, XLogP of 4.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6H-indolo[3,2-b]quinoxalin-9-yl-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 6067244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).