7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one

C12H12N2O2 — CID 115107432

IUPAC7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one
SMILESCOc1ccc2cc3n(c2c1)C(=O)CNC3
InChIInChI=1S/C12H12N2O2/c1-16-10-3-2-8-4-9-6-13-7-12(15)14(9)11(8)5-10/h2-5,13H,6-7H2,1H3
InChIKeyPLQNEXUPOHMVPH-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.39
Rot. Bonds1

About 7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one

7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one (PubChem CID 115107432) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one.

Molecular Properties

Compound Name7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one
PubChem CID115107432
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one
SMILESCOc1ccc2cc3n(c2c1)C(=O)CNC3
InChIInChI=1S/C12H12N2O2/c1-16-10-3-2-8-4-9-6-13-7-12(15)14(9)11(8)5-10/h2-5,13H,6-7H2,1H3
InChIKeyPLQNEXUPOHMVPH-UHFFFAOYSA-N
XLogP1.39
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-hydroxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one
CID 115107424
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CID 585094
1-[(3-methoxyphenyl)methyl]piperazine-2,6-dione
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7-methoxy-2,3-dihydro-1H-pyrrolo[1,2-a]indol-2-amine
CID 105454435
1-(4-methoxyphenyl)-1,4-diazocan-2-one
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3-methoxy-6,11-dihydroindolo[2,1-c][1,4]benzodiazepin-12-one
CID 13477805
3-ethyl-7-methoxy-1-methylquinolin-2-one
CID 143543946
7-methoxy-[1,3]thiazolo[3,2-a]benzimidazol-1-one
CID 12737162
6-(4-methoxyphenyl)-1-methylpiperazin-2-one
CID 83707128
6-methoxy-1-methylindol-2-ol
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1-(6-methoxynaphthalene-2-carbonyl)piperidine-2,6-dione
CID 132604473

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one?
The IUPAC name of 7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one (CID 115107432) is 7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one.
What is the SMILES notation for 7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one?
The canonical SMILES for 7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one is COc1ccc2cc3n(c2c1)C(=O)CNC3.
What is the InChIKey of 7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one?
The InChIKey is PLQNEXUPOHMVPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-16-10-3-2-8-4-9-6-13-7-12(15)14(9)11(8)5-10/h2-5,13H,6-7H2,1H3.
What are the key properties of 7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one?
7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one has a molecular weight of 216.24 g/mol, XLogP of 1.39, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2,3-dihydro-1H-pyrazino[1,2-a]indol-4-one is sourced from PubChem (CID 115107432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).