6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole

C12H13FN2 — CID 84620195

IUPAC6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
SMILESCc1c2n(c3c(F)cccc13)CCNC2
InChIInChI=1S/C12H13FN2/c1-8-9-3-2-4-10(13)12(9)15-6-5-14-7-11(8)15/h2-4,14H,5-7H2,1H3
InChIKeyWNFHSETWUUBOSL-UHFFFAOYSA-N
MW204.25 g/mol
LogP2.19
Rot. Bonds

About 6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole

6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole (PubChem CID 84620195) has the molecular formula C12H13FN2 and a molecular weight of 204.25 g/mol. Its IUPAC name is 6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole.

Molecular Properties

Compound Name6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
PubChem CID84620195
Molecular FormulaC12H13FN2
Molecular Weight204.25 g/mol
Exact Mass204.11
IUPAC Name6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
SMILESCc1c2n(c3c(F)cccc13)CCNC2
InChIInChI=1S/C12H13FN2/c1-8-9-3-2-4-10(13)12(9)15-6-5-14-7-11(8)15/h2-4,14H,5-7H2,1H3
InChIKeyWNFHSETWUUBOSL-UHFFFAOYSA-N
XLogP2.19
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.25
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

7-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
CID 84620202
6,9,10-trimethyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
CID 84622037
11-methyl-2,3,4,5-tetrahydro-1H-[1,4]diazepino[1,2-a]indole
CID 12864595
6-fluoro-5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indole;hydrochloride
CID 169428435
6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole-10-carbaldehyde
CID 84740760
6-methoxy-9,10-dimethyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
CID 84626274
6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
CID 84630615
10-methyl-8-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
CID 84625593
7-fluoro-1,3-dimethyl-2-piperidin-3-ylindole
CID 84632385
8-chloro-6-[4-chloro-3-(trifluoromethyl)phenyl]-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
CID 141390521
10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
CID 84621981
2-(6-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indol-10-yl)acetic acid
CID 84742781

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
The IUPAC name of 6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole (CID 84620195) is 6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole.
What is the SMILES notation for 6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
The canonical SMILES for 6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole is Cc1c2n(c3c(F)cccc13)CCNC2.
What is the InChIKey of 6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
The InChIKey is WNFHSETWUUBOSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN2/c1-8-9-3-2-4-10(13)12(9)15-6-5-14-7-11(8)15/h2-4,14H,5-7H2,1H3.
What are the key properties of 6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole has a molecular weight of 204.25 g/mol, XLogP of 2.19, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole is sourced from PubChem (CID 84620195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).