10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole

C12H14N2 — CID 22595906

IUPAC10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole
SMILESCC1C2CC=CC=C2N2C=CN=CC12
InChIInChI=1S/C12H14N2/c1-9-10-4-2-3-5-11(10)14-7-6-13-8-12(9)14/h2-3,5-10,12H,4H2,1H3
InChIKeyBKZFMHRZRRKUFA-UHFFFAOYSA-N
MW186.26 g/mol
LogP2.32
Rot. Bonds

About 10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole

10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole (PubChem CID 22595906) has the molecular formula C12H14N2 and a molecular weight of 186.26 g/mol. Its IUPAC name is 10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole.

Molecular Properties

Compound Name10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole
PubChem CID22595906
Molecular FormulaC12H14N2
Molecular Weight186.26 g/mol
Exact Mass186.12
IUPAC Name10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole
SMILESCC1C2CC=CC=C2N2C=CN=CC12
InChIInChI=1S/C12H14N2/c1-9-10-4-2-3-5-11(10)14-7-6-13-8-12(9)14/h2-3,5-10,12H,4H2,1H3
InChIKeyBKZFMHRZRRKUFA-UHFFFAOYSA-N
XLogP2.32
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.26
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole?
The IUPAC name of 10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole (CID 22595906) is 10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole.
What is the SMILES notation for 10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole?
The canonical SMILES for 10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole is CC1C2CC=CC=C2N2C=CN=CC12.
What is the InChIKey of 10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole?
The InChIKey is BKZFMHRZRRKUFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2/c1-9-10-4-2-3-5-11(10)14-7-6-13-8-12(9)14/h2-3,5-10,12H,4H2,1H3.
What are the key properties of 10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole?
10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole has a molecular weight of 186.26 g/mol, XLogP of 2.32, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methyl-9,9a,10,10a-tetrahydropyrazino[1,2-a]indole is sourced from PubChem (CID 22595906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).