2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline

C18H17N3 — CID 103965038

IUPAC2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline
SMILESCC1(c2ccccc2)CNc2cnc3ccccc3c2N1
InChIInChI=1S/C18H17N3/c1-18(13-7-3-2-4-8-13)12-20-16-11-19-15-10-6-5-9-14(15)17(16)21-18/h2-11,20-21H,12H2,1H3
InChIKeyFPMOYIQRZMVYTA-UHFFFAOYSA-N
MW275.36 g/mol
LogP3.99
Rot. Bonds1

About 2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline

2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline (PubChem CID 103965038) has the molecular formula C18H17N3 and a molecular weight of 275.36 g/mol. Its IUPAC name is 2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline.

Molecular Properties

Compound Name2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline
PubChem CID103965038
Molecular FormulaC18H17N3
Molecular Weight275.36 g/mol
Exact Mass275.14
IUPAC Name2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline
SMILESCC1(c2ccccc2)CNc2cnc3ccccc3c2N1
InChIInChI=1S/C18H17N3/c1-18(13-7-3-2-4-8-13)12-20-16-11-19-15-10-6-5-9-14(15)17(16)21-18/h2-11,20-21H,12H2,1H3
InChIKeyFPMOYIQRZMVYTA-UHFFFAOYSA-N
XLogP3.99
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline?
The IUPAC name of 2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline (CID 103965038) is 2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline.
What is the SMILES notation for 2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline?
The canonical SMILES for 2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline is CC1(c2ccccc2)CNc2cnc3ccccc3c2N1.
What is the InChIKey of 2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline?
The InChIKey is FPMOYIQRZMVYTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3/c1-18(13-7-3-2-4-8-13)12-20-16-11-19-15-10-6-5-9-14(15)17(16)21-18/h2-11,20-21H,12H2,1H3.
What are the key properties of 2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline?
2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline has a molecular weight of 275.36 g/mol, XLogP of 3.99, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-phenyl-3,4-dihydro-1H-pyrazino[2,3-c]quinoline is sourced from PubChem (CID 103965038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).