4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine

C14H24N6O — CID 80837412

IUPAC4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine
SMILESCNc1nc(OC)nc(N2CC3CCCCN3CC2C)n1
InChIInChI=1S/C14H24N6O/c1-10-8-19-7-5-4-6-11(19)9-20(10)13-16-12(15-2)17-14(18-13)21-3/h10-11H,4-9H2,1-3H3,(H,15,16,17,18)
InChIKeyPBJXVDJYWDSMBQ-UHFFFAOYSA-N
MW292.39 g/mol
LogP0.98
Rot. Bonds3

About 4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine

4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine (PubChem CID 80837412) has the molecular formula C14H24N6O and a molecular weight of 292.39 g/mol. Its IUPAC name is 4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine
PubChem CID80837412
Molecular FormulaC14H24N6O
Molecular Weight292.39 g/mol
Exact Mass292.20
IUPAC Name4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine
SMILESCNc1nc(OC)nc(N2CC3CCCCN3CC2C)n1
InChIInChI=1S/C14H24N6O/c1-10-8-19-7-5-4-6-11(19)9-20(10)13-16-12(15-2)17-14(18-13)21-3/h10-11H,4-9H2,1-3H3,(H,15,16,17,18)
InChIKeyPBJXVDJYWDSMBQ-UHFFFAOYSA-N
XLogP0.98
TPSA66.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine with MolForge

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Related Compounds

4-ethoxy-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine
CID 80836544
[4-methoxy-6-(2-methylpiperidin-1-yl)-1,3,5-triazin-2-yl]hydrazine
CID 80927925
2-N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80807429
N-methyl-1-[6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-pyridinyl]methanamine
CID 79925045
2-(2,5-dimethoxyphenyl)-3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 79916612
[4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine
CID 80899588
4-chloro-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine
CID 80854716
2-(4-methoxy-2-methylphenyl)-3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 79926871
4-(4,4-dimethylpiperidin-1-yl)-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80823839
6-methoxy-2-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyridin-3-amine
CID 115320947
2-(6-fluoropyrimidin-4-yl)-3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 115417184
4-methoxy-N-methyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine
CID 80767737

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine (CID 80837412) is 4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine is CNc1nc(OC)nc(N2CC3CCCCN3CC2C)n1.
What is the InChIKey of 4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine?
The InChIKey is PBJXVDJYWDSMBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N6O/c1-10-8-19-7-5-4-6-11(19)9-20(10)13-16-12(15-2)17-14(18-13)21-3/h10-11H,4-9H2,1-3H3,(H,15,16,17,18).
What are the key properties of 4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine?
4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine has a molecular weight of 292.39 g/mol, XLogP of 0.98, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-methyl-6-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 80837412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).