6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole

C16H22N2 — CID 84630615

IUPAC6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
SMILESCCc1cccc2c(C(C)C)c3n(c12)CCNC3
InChIInChI=1S/C16H22N2/c1-4-12-6-5-7-13-15(11(2)3)14-10-17-8-9-18(14)16(12)13/h5-7,11,17H,4,8-10H2,1-3H3
InChIKeyGSRRMXZYAOUJKB-UHFFFAOYSA-N
MW242.37 g/mol
LogP3.43
Rot. Bonds2

About 6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole

6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole (PubChem CID 84630615) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is 6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole.

Molecular Properties

Compound Name6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
PubChem CID84630615
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC Name6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
SMILESCCc1cccc2c(C(C)C)c3n(c12)CCNC3
InChIInChI=1S/C16H22N2/c1-4-12-6-5-7-13-15(11(2)3)14-10-17-8-9-18(14)16(12)13/h5-7,11,17H,4,8-10H2,1-3H3
InChIKeyGSRRMXZYAOUJKB-UHFFFAOYSA-N
XLogP3.43
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 53.43
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

10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
CID 84621981
6-ethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazole
CID 84619763
2-(6-chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indol-10-yl)acetic acid
CID 84742781
6-fluoro-10-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
CID 84620195
6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indole-10-carbaldehyde
CID 84740760
bis(1,3-diethyl-2-propan-2-ylbenzene);bis(2-methylpropane)
CID 159950653
3-(6-methoxy-1,2,3,4-tetrahydropyrazino[1,2-a]indol-10-yl)propanoic acid
CID 84743259
2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine
CID 82495320
1-[(2-ethylphenyl)methyl]piperazine
CID 62415674
2-ethyl-6-(1-piperazin-1-ylethyl)phenol
CID 83896226
1,2,3,4-tetrahydropyrazino[1,2-a]indole-10-carbaldehyde
CID 82397497
10-methyl-8-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
CID 84625593

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
The IUPAC name of 6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole (CID 84630615) is 6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole.
What is the SMILES notation for 6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
The canonical SMILES for 6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole is CCc1cccc2c(C(C)C)c3n(c12)CCNC3.
What is the InChIKey of 6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
The InChIKey is GSRRMXZYAOUJKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2/c1-4-12-6-5-7-13-15(11(2)3)14-10-17-8-9-18(14)16(12)13/h5-7,11,17H,4,8-10H2,1-3H3.
What are the key properties of 6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole?
6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole has a molecular weight of 242.37 g/mol, XLogP of 3.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-10-propan-2-yl-1,2,3,4-tetrahydropyrazino[1,2-a]indole is sourced from PubChem (CID 84630615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).