6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole

C12H14N2O — CID 25186020

IUPAC6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole
SMILESCOc1cccc2cc3n(c12)CCNC3
InChIInChI=1S/C12H14N2O/c1-15-11-4-2-3-9-7-10-8-13-5-6-14(10)12(9)11/h2-4,7,13H,5-6,8H2,1H3
InChIKeyNVWYMOYTOXXDBN-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.75
Rot. Bonds1

About 6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole

6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole (PubChem CID 25186020) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole.

Molecular Properties

Compound Name6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole
PubChem CID25186020
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole
SMILESCOc1cccc2cc3n(c12)CCNC3
InChIInChI=1S/C12H14N2O/c1-15-11-4-2-3-9-7-10-8-13-5-6-14(10)12(9)11/h2-4,7,13H,5-6,8H2,1H3
InChIKeyNVWYMOYTOXXDBN-UHFFFAOYSA-N
XLogP1.75
TPSA26.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
The IUPAC name of 6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole (CID 25186020) is 6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole.
What is the SMILES notation for 6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
The canonical SMILES for 6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole is COc1cccc2cc3n(c12)CCNC3.
What is the InChIKey of 6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
The InChIKey is NVWYMOYTOXXDBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-15-11-4-2-3-9-7-10-8-13-5-6-14(10)12(9)11/h2-4,7,13H,5-6,8H2,1H3.
What are the key properties of 6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole has a molecular weight of 202.26 g/mol, XLogP of 1.75, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole is sourced from PubChem (CID 25186020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).