8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole

C11H13FN2 — CID 58941055

IUPAC8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole
SMILESFc1ccc2c(c1)CC1CNCCN21
InChIInChI=1S/C11H13FN2/c12-9-1-2-11-8(5-9)6-10-7-13-3-4-14(10)11/h1-2,5,10,13H,3-4,6-7H2
InChIKeyFPFIPQUHSRUKIA-UHFFFAOYSA-N
MW192.24 g/mol
LogP1.16
Rot. Bonds

About 8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole

8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole (PubChem CID 58941055) has the molecular formula C11H13FN2 and a molecular weight of 192.24 g/mol. Its IUPAC name is 8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole.

Molecular Properties

Compound Name8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole
PubChem CID58941055
Molecular FormulaC11H13FN2
Molecular Weight192.24 g/mol
Exact Mass192.11
IUPAC Name8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole
SMILESFc1ccc2c(c1)CC1CNCCN21
InChIInChI=1S/C11H13FN2/c12-9-1-2-11-8(5-9)6-10-7-13-3-4-14(10)11/h1-2,5,10,13H,3-4,6-7H2
InChIKeyFPFIPQUHSRUKIA-UHFFFAOYSA-N
XLogP1.16
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole?
The IUPAC name of 8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole (CID 58941055) is 8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole.
What is the SMILES notation for 8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole?
The canonical SMILES for 8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole is Fc1ccc2c(c1)CC1CNCCN21.
What is the InChIKey of 8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole?
The InChIKey is FPFIPQUHSRUKIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2/c12-9-1-2-11-8(5-9)6-10-7-13-3-4-14(10)11/h1-2,5,10,13H,3-4,6-7H2.
What are the key properties of 8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole?
8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole has a molecular weight of 192.24 g/mol, XLogP of 1.16, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole is sourced from PubChem (CID 58941055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).