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

C11H11ClN2 — CID 14595512

IUPAC8-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole
SMILESClc1ccc2c(c1)cc1n2CCNC1
InChIInChI=1S/C11H11ClN2/c12-9-1-2-11-8(5-9)6-10-7-13-3-4-14(10)11/h1-2,5-6,13H,3-4,7H2
InChIKeyQKGDOWUCRMVFPY-UHFFFAOYSA-N
MW206.68 g/mol
LogP2.40
Rot. Bonds

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

8-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole (PubChem CID 14595512) has the molecular formula C11H11ClN2 and a molecular weight of 206.68 g/mol. Its IUPAC name is 8-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole.

Molecular Properties

Compound Name8-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole
PubChem CID14595512
Molecular FormulaC11H11ClN2
Molecular Weight206.68 g/mol
Exact Mass206.06
IUPAC Name8-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole
SMILESClc1ccc2c(c1)cc1n2CCNC1
InChIInChI=1S/C11H11ClN2/c12-9-1-2-11-8(5-9)6-10-7-13-3-4-14(10)11/h1-2,5-6,13H,3-4,7H2
InChIKeyQKGDOWUCRMVFPY-UHFFFAOYSA-N
XLogP2.40
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.68
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
The IUPAC name of 8-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole (CID 14595512) is 8-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole.
What is the SMILES notation for 8-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
The canonical SMILES for 8-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole is Clc1ccc2c(c1)cc1n2CCNC1.
What is the InChIKey of 8-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
The InChIKey is QKGDOWUCRMVFPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN2/c12-9-1-2-11-8(5-9)6-10-7-13-3-4-14(10)11/h1-2,5-6,13H,3-4,7H2.
What are the key properties of 8-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
8-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole has a molecular weight of 206.68 g/mol, XLogP of 2.40, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole is sourced from PubChem (CID 14595512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).