3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one

C16H18N2O2 — CID 129165372

IUPAC3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one
SMILESCC1Cn2cc(OCc3ccccc3)c(=O)cc2CN1
InChIInChI=1S/C16H18N2O2/c1-12-9-18-10-16(15(19)7-14(18)8-17-12)20-11-13-5-3-2-4-6-13/h2-7,10,12,17H,8-9,11H2,1H3
InChIKeyYOSYPAHTUPHUJC-UHFFFAOYSA-N
MW270.33 g/mol
LogP1.92
Rot. Bonds3

About 3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one

3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one (PubChem CID 129165372) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one.

Molecular Properties

Compound Name3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one
PubChem CID129165372
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one
SMILESCC1Cn2cc(OCc3ccccc3)c(=O)cc2CN1
InChIInChI=1S/C16H18N2O2/c1-12-9-18-10-16(15(19)7-14(18)8-17-12)20-11-13-5-3-2-4-6-13/h2-7,10,12,17H,8-9,11H2,1H3
InChIKeyYOSYPAHTUPHUJC-UHFFFAOYSA-N
XLogP1.92
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3R)-2-(cyclohexa-1,3-dien-1-ylmethyl)-3-phenyl-7-phenylmethoxy-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one
CID 129181679
2-(aminomethyl)-1-methyl-5-phenylmethoxypyridin-4-one
CID 11172595
(3S)-1-[(4-bromo-3-phenylmethoxyphenyl)methyl]-3-methylpiperazine
CID 176508387
2,5-bis(phenylmethoxy)-1H-pyridin-4-one
CID 54191068
1-benzyl-4-oxo-5-phenylmethoxypyridine-2-carbaldehyde
CID 4607667
3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline
CID 62375582
1-(4-methoxy-3-phenylmethoxyphenyl)-4-methyl-1,3-diazinan-2-one
CID 155170009
2-[2-methyl-5-[(4-methylphenyl)methoxy]-4-oxo-1-pyridinyl]-N-(2-phenylethyl)acetamide
CID 16852935
2-[3,4-bis(phenylmethoxy)phenyl]-N-(1,2-diethylpyrazolidin-4-yl)acetamide
CID 139707195
5-hydroxy-2-methyl-1H-pyridin-4-one;2-methyl-5-phenylmethoxy-1H-pyridin-4-one;hydrochloride
CID 161262115
1-benzyl-N-(2,5-dioxoimidazolidin-1-yl)-4-oxo-5-phenylmethoxypyridine-2-carboxamide
CID 14326676
2-(hydroxymethyl)-1-(2-hydroxy-4-phenylbutyl)-5-phenylmethoxypyridin-4-one
CID 140931594

Frequently Asked Questions

What is the IUPAC name of 3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one?
The IUPAC name of 3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one (CID 129165372) is 3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one.
What is the SMILES notation for 3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one?
The canonical SMILES for 3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one is CC1Cn2cc(OCc3ccccc3)c(=O)cc2CN1.
What is the InChIKey of 3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one?
The InChIKey is YOSYPAHTUPHUJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-12-9-18-10-16(15(19)7-14(18)8-17-12)20-11-13-5-3-2-4-6-13/h2-7,10,12,17H,8-9,11H2,1H3.
What are the key properties of 3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one?
3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one has a molecular weight of 270.33 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-7-phenylmethoxy-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-8-one is sourced from PubChem (CID 129165372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).