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

C12H14N2O — CID 10420386

IUPAC8-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole
SMILESCOc1ccc2c(c1)cc1n2CCNC1
InChIInChI=1S/C12H14N2O/c1-15-11-2-3-12-9(7-11)6-10-8-13-4-5-14(10)12/h2-3,6-7,13H,4-5,8H2,1H3
InChIKeyOCHMVUBCWNSWJE-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.75
Rot. Bonds1

About 8-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole

8-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole (PubChem CID 10420386) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 8-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole.

Molecular Properties

Compound Name8-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole
PubChem CID10420386
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name8-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole
SMILESCOc1ccc2c(c1)cc1n2CCNC1
InChIInChI=1S/C12H14N2O/c1-15-11-2-3-12-9(7-11)6-10-8-13-4-5-14(10)12/h2-3,6-7,13H,4-5,8H2,1H3
InChIKeyOCHMVUBCWNSWJE-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 8-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
The IUPAC name of 8-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole (CID 10420386) is 8-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole.
What is the SMILES notation for 8-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
The canonical SMILES for 8-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole is COc1ccc2c(c1)cc1n2CCNC1.
What is the InChIKey of 8-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
The InChIKey is OCHMVUBCWNSWJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-15-11-2-3-12-9(7-11)6-10-8-13-4-5-14(10)12/h2-3,6-7,13H,4-5,8H2,1H3.
What are the key properties of 8-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
8-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 8-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole is sourced from PubChem (CID 10420386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).